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Pyrazolopyrimidines
Description:
Compounds containing a pyrazolopyrimidine skeleton, which consists of a pyrazole fused to a pyrimidine. Pyrazole is 5-membered ring consisting of three carbon atoms and two adjacent nitrogen centers. Pyrimidine is 6-membered ring consisting of four carbon atoms and two adjacent nitrogen atoms at the 1- and 3- ring position.
Ancestors:
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ethyl 5-chloropyrazolo[1,5-a]pyrimidine-2-carboxylateCas Number: 1363405-21-3 Compound CID: 71627143Formula: C9H8ClN3O2IUPAC Name: ethyl 5-chloropyrazolo[1,5-a]pyrimidine-2-carboxylateSMILES: CCOC(=O)C1=NN2C=CC(=NC2=C1)ClInChIKey: HVKZDATVDUBOCP-UHFFFAOYSA-NInChI: InChI=1S/C9H8ClN3O2/c1-2-15-9(14)6-5-8-11-7(10)3-4-13(8)12-6/h3-5H,2H2,1H3 -
ethyl 5,7-dichloropyrazolo[1,5-a]pyrimidine-2-carboxylateCas Number: 1232224-62-2 Compound CID: 86674517Formula: C9H7Cl2N3O2 Molecular Weight: 260.07IUPAC Name: ethyl 5,7-dichloropyrazolo[1,5-a]pyrimidine-2-carboxylateSMILES: CCOC(=O)C1=NN2C(=C1)N=C(C=C2Cl)ClInChIKey: PLWMWQRVHWSVEM-UHFFFAOYSA-NInChI: InChI=1S/C9H7Cl2N3O2/c1-2-16-9(15)5-3-8-12-6(10)4-7(11)14(8)13-5/h3-4H,2H2,1H3 -
N-benzyl-5-chloro-3-isopropyl-pyrazolo[1,5-a]pyrimidin-7-amineCas Number: 1092443-98-5 Compound CID: 25123362IUPAC Name: N-benzyl-5-chloro-3-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-amineSMILES: CC(C)C1=C2N=C(C=C(N2N=C1)NCC3=CC=CC=C3)ClInChIKey: DPLYAMCNFUJBLH-UHFFFAOYSA-NInChI: InChI=1S/C16H17ClN4/c1-11(2)13-10-19-21-15(8-14(17)20-16(13)21)18-9-12-6-4-3-5-7-12/h3-8,10-11,18H,9H2,1-2H3 -
6-methyl-1,5-dihydropyrazolo[3,4-d]pyrimidin-4-oneCas Number: 30129-57-8 Compound CID: 135456970Formula: C6H6N4O Molecular Weight: 150.14IUPAC Name: 6-methyl-1,5-dihydropyrazolo[3,4-d]pyrimidin-4-oneSMILES: CC1=NC2=C(C=NN2)C(=O)N1InChIKey: OCEQBYVMMNGTIV-UHFFFAOYSA-NInChI: InChI=1S/C6H6N4O/c1-3-8-5-4(2-7-10-5)6(11)9-3/h2H,1H3,(H2,7,8,9,10,11) -
6-chloropyrazolo[1,5-a]pyrimidineCas Number: 2024538-64-3 Compound CID: 89620457Formula: C6H4ClN3 Molecular Weight: 153.57SMILES: C1=C2N=CC(=CN2N=C1)ClInChIKey: FQXQOIGAJJUUNH-UHFFFAOYSA-NInChI: InChI=1S/C6H4ClN3/c7-5-3-8-6-1-2-9-10(6)4-5/h1-4H
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6-Chloro-3-methyl-1H-pyrazolo[3,4-d]pyrimidineCas Number: 871254-63-6 Compound CID: 17569283Formula: C6H5ClN4 Molecular Weight: 168.58SMILES: CC1=C2C=NC(=NC2=NN1)ClInChIKey: GAIAJUYBHMCMHP-UHFFFAOYSA-NInChI: InChI=1S/C6H5ClN4/c1-3-4-2-8-6(7)9-5(4)11-10-3/h2H,1H3,(H,8,9,10,11)
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4-methoxy-1H-pyrazolo[3,4-d]pyrimidineCas Number: 5399-93-9 Compound CID: 221096IUPAC Name: 4-methoxy-1H-pyrazolo[3,4-d]pyrimidineSMILES: COC1=NC=NC2=C1C=NN2InChIKey: HRYFDIMIODFAJD-UHFFFAOYSA-NInChI: InChI=1S/C6H6N4O/c1-11-6-4-2-9-10-5(4)7-3-8-6/h2-3H,1H3,(H,7,8,9,10)
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3-bromopyrazolo[1,5-a]pyrimidin-6-olCas Number: 1314893-97-4 Compound CID: 67348134IUPAC Name: 3-bromopyrazolo[1,5-a]pyrimidin-6-olSMILES: C1=C(C=NC2=C(C=NN21)Br)OInChIKey: GQGBGKOBAQHWHL-UHFFFAOYSA-NInChI: InChI=1S/C6H4BrN3O/c7-5-2-9-10-3-4(11)1-8-6(5)10/h1-3,11H
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3-bromopyrazolo[1,5-a]pyrimidin-6-amineCas Number: 1367955-95-0 Compound CID: 82394285Formula: C6H5BrN4 Molecular Weight: 213.03IUPAC Name: 3-bromopyrazolo[1,5-a]pyrimidin-6-amineSMILES: C1=C(C=NC2=C(C=NN21)Br)NInChIKey: JLWUZECBEONKGI-UHFFFAOYSA-NInChI: InChI=1S/C6H5BrN4/c7-5-2-10-11-3-4(8)1-9-6(5)11/h1-3H,8H2
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3-bromo-6-methylpyrazolo[1,5-a]pyrimidineCas Number: 1263060-64-5 Compound CID: 18732329Formula: C7H6BrN3 Molecular Weight: 212.05IUPAC Name: 3-bromo-6-methylpyrazolo[1,5-a]pyrimidineSMILES: CC1=CN2C(=C(C=N2)Br)N=C1InChIKey: IRBYARMSVILOKF-UHFFFAOYSA-NInChI: InChI=1S/C7H6BrN3/c1-5-2-9-7-6(8)3-10-11(7)4-5/h2-4H,1H3
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3-bromo-5-chloropyrazolo[1,5-a]pyrimidin-7-amineCas Number: 674297-88-2 Compound CID: 23544844Formula: C6H4BrClN4 Molecular Weight: 247.48SMILES: C1=C(N2C(=C(C=N2)Br)N=C1Cl)NInChIKey: PWIODDUWXYZRSN-UHFFFAOYSA-NInChI: InChI=1S/C6H4BrClN4/c7-3-2-10-12-5(9)1-4(8)11-6(3)12/h1-2H,9H2
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2-methylpyrazolo[1,5-a]pyrimidine-3-carboxylic acidCas Number: 96319-38-9 Compound CID: 3159636Formula: C8H7N3O2 Molecular Weight: 177.16IUPAC Name: 2-methylpyrazolo[1,5-a]pyrimidine-3-carboxylic acidSMILES: CC1=NN2C=CC=NC2=C1C(=O)OInChIKey: IRJAFYDJCLVTRN-UHFFFAOYSA-NInChI: InChI=1S/C8H7N3O2/c1-5-6(8(12)13)7-9-3-2-4-11(7)10-5/h2-4H,1H3,(H,12,13)
