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3,4,5-trisubstituted-2-aminothiophenes

Description:

Organic compounds containing a thiophene ring substituted at the 2-,3-,4-, and 5-position, with an amine group at the 2-position.
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Items 1-12 of 47

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  1. Ethyl 2-amino-3-cyano-4,5,6,7-tetrahydrobenzo[b]thiophene-4-carboxylate
      Grade & Purity: 
    • ≥95%
    Cas Number: 175599-83-4        Compound CID:  383365
    Formula:  C12H14N2O2S        Molecular Weight: 250.32
    IUPAC Name:  ethyl 2-amino-3-cyano-4,5,6,7-tetrahydro-1-benzothiophene-4-carboxylate
    SMILES:  CCOC(=O)C1CCCC2=C1C(=C(S2)N)C#N
    InChIKey: BHUBUJRJDMFTKE-UHFFFAOYSA-N
    InChI:  InChI=1S/C12H14N2O2S/c1-2-16-12(15)7-4-3-5-9-10(7)8(6-13)11(14)17-9/h7H,2-5,14H2,1H3
  2. 2-Amino-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylic acid
      Grade & Purity: 
    • ≥98%
    Cas Number: 5936-58-3        Compound CID:  3108410
    Formula:  C9H11NO2S        Molecular Weight: 197.26
    IUPAC Name:  2-amino-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid
    SMILES:  C1CCC2=C(C1)C(=C(S2)N)C(=O)O
    InChIKey: WYOLDVOOOYZSJM-UHFFFAOYSA-N
    InChI:  InChI=1S/C9H11NO2S/c10-8-7(9(11)12)5-3-1-2-4-6(5)13-8/h1-4,10H2,(H,11,12)
  3. 2-Amino-6-ethyl-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carbonitrile
      Grade & Purity: 
    • ≥97%
    Cas Number: 329222-96-0        Compound CID:  591762
    Formula:  C11H14N2S        Molecular Weight: 206.31
    IUPAC Name:  2-amino-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile
    SMILES:  CCC1CCC2=C(C1)SC(=C2C#N)N
    InChIKey: UJSSIVVJQQNBCO-UHFFFAOYSA-N
    InChI:  InChI=1S/C11H14N2S/c1-2-7-3-4-8-9(6-12)11(13)14-10(8)5-7/h7H,2-5,13H2,1H3
  4. Dimethyl 5-amino-3-methylthiophene-2,4-dicarboxylate
      Grade & Purity: 
    • ≥99%
    Cas Number: 103765-33-9        Compound CID:  607607
    Formula:  C9H11NO4S        Molecular Weight: 229.26
    IUPAC Name:  dimethyl 5-amino-3-methylthiophene-2,4-dicarboxylate
    SMILES:  CC1=C(SC(=C1C(=O)OC)N)C(=O)OC
    InChIKey: JNLHLSOENLVUIJ-UHFFFAOYSA-N
    InChI:  InChI=1S/C9H11NO4S/c1-4-5(8(11)13-2)7(10)15-6(4)9(12)14-3/h10H2,1-3H3
  5. Methyl 3-amino-4-cyano-5-(piperidin-1-yl)thiophene-2-carboxylate
      Grade & Purity: 
    • ≥98%
    Cas Number: 499771-09-4        Compound CID:  2819895
    Formula:  C12H15N3O2S        Molecular Weight: 265.33
    IUPAC Name:  methyl 3-amino-4-cyano-5-piperidin-1-ylthiophene-2-carboxylate
    SMILES:  COC(=O)C1=C(C(=C(S1)N2CCCCC2)C#N)N
    InChIKey: AMEIYXKGIMEQBV-UHFFFAOYSA-N
    InChI:  InChI=1S/C12H15N3O2S/c1-17-12(16)10-9(14)8(7-13)11(18-10)15-5-3-2-4-6-15/h2-6,14H2,1H3
  6. 5-Amino-3-methylthiophene-2,4-dicarbonitrile
      Grade & Purity: 
    • ≥97%
    Cas Number: 52603-48-2        Compound CID:  819555
    Formula:  C7H5N3S        Molecular Weight: 163.2
    IUPAC Name:  5-amino-3-methylthiophene-2,4-dicarbonitrile
    SMILES:  CC1=C(SC(=C1C#N)N)C#N
    InChIKey: GCSCENSWKWQJQG-UHFFFAOYSA-N
    InChI:  InChI=1S/C7H5N3S/c1-4-5(2-8)7(10)11-6(4)3-9/h10H2,1H3
  7. 2-TERT-BUTYL 4-ETHYL 5-AMINO-3-METHYLTHIOPHENE-2,4-DICARBOXYLATE
      Grade & Purity: 
    • ≥95%
    Cas Number: 257610-86-9        Compound CID:  869563
    Formula:  C13H19NO4S        Molecular Weight: 285.35
    IUPAC Name:  2-O-tert-butyl 4-O-ethyl 5-amino-3-methylthiophene-2,4-dicarboxylate
    SMILES:  CCOC(=O)C1=C(SC(=C1C)C(=O)OC(C)(C)C)N
    InChIKey: BIYRGKXJVULHKF-UHFFFAOYSA-N
    InChI:  InChI=1S/C13H19NO4S/c1-6-17-11(15)8-7(2)9(19-10(8)14)12(16)18-13(3,4)5/h6,14H2,1-5H3
  8. 2-Ethyl 4-methyl 5-amino-3-methylthiophene-2,4-dicarboxylate
      Grade & Purity: 
    • ≥95%
    Cas Number: 77457-04-6        Compound CID:  674780
    Formula:  C10H13NO4S        Molecular Weight: 243.28
    IUPAC Name:  2-O-ethyl 4-O-methyl 5-amino-3-methylthiophene-2,4-dicarboxylate
    SMILES:  CCOC(=O)C1=C(C(=C(S1)N)C(=O)OC)C
    InChIKey: NWMDHEXWYNCAME-UHFFFAOYSA-N
    InChI:  InChI=1S/C10H13NO4S/c1-4-15-10(13)7-5(2)6(8(11)16-7)9(12)14-3/h4,11H2,1-3H3
  9. 2-Amino-6-propyl-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carbonitrile
      Grade & Purity: 
    • ≥97%
    Cas Number: 350996-91-7        Compound CID:  2887397
    Formula:  C12H16N2S        Molecular Weight: 220.34
    IUPAC Name:  2-amino-6-propyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile
    SMILES:  CCCC1CCC2=C(C1)SC(=C2C#N)N
    InChIKey: CMJOQDLSCOMRQU-UHFFFAOYSA-N
    InChI:  InChI=1S/C12H16N2S/c1-2-3-8-4-5-9-10(7-13)12(14)15-11(9)6-8/h8H,2-6,14H2,1H3
  10. 2-Amino-6-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile
      Grade & Purity: 
    • ≥98%
    Cas Number: 42159-76-2        Compound CID:  616417
    Formula:  C13H18N2S        Molecular Weight: 234.37
    IUPAC Name:  2-amino-6-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile
    SMILES:  CC(C)(C)C1CCC2=C(C1)SC(=C2C#N)N
    InChIKey: QDIYAWBTKKYATE-UHFFFAOYSA-N
    InChI:  InChI=1S/C13H18N2S/c1-13(2,3)8-4-5-9-10(7-14)12(15)16-11(9)6-8/h8H,4-6,15H2,1-3H3
  11. 2-Amino-6-ethyl-4,5,6,7-tetrahydrobenzo[b]-thiophene-3-carboxylic acid methyl ester
      Grade & Purity: 
    • ≥90%
    Cas Number: 351980-88-6        Compound CID:  2756429
    Formula:  C12H17NO2S        Molecular Weight: 239.33
    IUPAC Name:  methyl 2-amino-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
    SMILES:  CCC1CCC2=C(C1)SC(=C2C(=O)OC)N
    InChIKey: OAGCBMZNJLDSNV-UHFFFAOYSA-N
    InChI:  InChI=1S/C12H17NO2S/c1-3-7-4-5-8-9(6-7)16-11(13)10(8)12(14)15-2/h7H,3-6,13H2,1-2H3
  12. 2-Amino-6-Methyl-4,5,6,7-Tetrahydro-Benzo[B]Thiophene-3-Carboxylic Acid Amide
      Grade & Purity: 
    • ≥97%
    Cas Number: 95211-68-0        Compound CID:  2852749
    Formula:  C10H14N2OS        Molecular Weight: 210.3
    IUPAC Name:  2-amino-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
    SMILES:  CC1CCC2=C(C1)SC(=C2C(=O)N)N
    InChIKey: LSRQCZCDBRHPHQ-UHFFFAOYSA-N
    InChI:  InChI=1S/C10H14N2OS/c1-5-2-3-6-7(4-5)14-10(12)8(6)9(11)13/h5H,2-4,12H2,1H3,(H2,11,13)
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