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Pyrimidinethiones
Description:
Compounds containing a pyrimidine ring that bears a thioketone. Pyrimidine is a 6-membered ring consisting of four carbon atoms and two nitrogen centers at the 1- and 3- ring positions.
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2-MERCAPTO-4-METHYLPYRIMIDINECas Number: 35071-17-1Formula: C5H6N2S Molecular Weight: 126.1795SMILES: CC1=CC=NC(=S)N1InChIKey: BVPHXTUEZOQIBS-UHFFFAOYSA-NInChI: InChI=1S/C5H6N2S/c1-4-2-3-6-5(8)7-4/h2-3H,1H3,(H,6,7,8) -
2-Mercapto-5-n-propylpyrimidineCas Number: 52767-84-7 Compound CID: 12356156Formula: C7H10N2S Molecular Weight: 154.24IUPAC Name: 5-propyl-1H-pyrimidine-2-thioneSMILES: CCCC1=CNC(=S)N=C1InChIKey: YZFGTZRDMRKBBU-UHFFFAOYSA-NInChI: InChI=1S/C7H10N2S/c1-2-3-6-4-8-7(10)9-5-6/h4-5H,2-3H2,1H3,(H,8,9,10)
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6-Methylpyrimidine-4(3H)-thioneCas Number: 51793-97-6 Compound CID: 4557596Formula: C5H6N2S Molecular Weight: 126.18IUPAC Name: 6-methyl-1H-pyrimidine-4-thioneSMILES: CC1=CC(=S)N=CN1InChIKey: HCADPDLQEAZJJN-UHFFFAOYSA-NInChI: InChI=1S/C5H6N2S/c1-4-2-5(8)7-3-6-4/h2-3H,1H3,(H,6,7,8)Synonyms: 6-Methylpyrimidine-4-thiol | 6-methyl-1H-pyrimidine-4-thione | 4(1H)-Pyrimidinethione, 6-methyl- (9CI)
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4，6-Dimethylpyrimidine-2(1H)-thione hydrochlorideCas Number: 62501-45-5 EC Number: 263-578-5, 248-883-3 Compound CID: 2729245Formula: C6H9ClN2S Molecular Weight: 176.67IUPAC Name: 4,6-dimethyl-1H-pyrimidine-2-thione;hydrochlorideSMILES: CC1=CC(=NC(=S)N1)C.ClInChIKey: KAHPDWLNROMIHC-UHFFFAOYSA-NInChI: InChI=1S/C6H8N2S.ClH/c1-4-3-5(2)8-6(9)7-4;/h3H,1-2H3,(H,7,8,9);1H
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4-Methyl-6-(trifluoromethyl)pyrimidine-2-thiolCas Number: 78018-17-4 Compound CID: 673683Formula: C6H5F3N2S Molecular Weight: 194.18IUPAC Name: 6-methyl-4-(trifluoromethyl)-1H-pyrimidine-2-thioneSMILES: CC1=CC(=NC(=S)N1)C(F)(F)FInChIKey: KKAFDOIDJWXCHG-UHFFFAOYSA-NInChI: InChI=1S/C6H5F3N2S/c1-3-2-4(6(7,8)9)11-5(12)10-3/h2H,1H3,(H,10,11,12)
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4-(2-Furyl)-2-pyrimidinethiolCas Number: 190579-95-4 Compound CID: 2824243Formula: C8H6N2OS Molecular Weight: 178.21IUPAC Name: 6-(furan-2-yl)-1H-pyrimidine-2-thioneSMILES: C1=COC(=C1)C2=CC=NC(=S)N2InChIKey: YGXHXJRIPUVEGH-UHFFFAOYSA-NInChI: InChI=1S/C8H6N2OS/c12-8-9-4-3-6(10-8)7-2-1-5-11-7/h1-5H,(H,9,10,12)
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2-Amino-6-methylpyrimidine-4-thiolCas Number: 6307-44-4 Compound CID: 2781477Formula: C5H7N3S Molecular Weight: 141.2IUPAC Name: 2-amino-6-methyl-1H-pyrimidine-4-thioneSMILES: CC1=CC(=S)N=C(N1)NInChIKey: VWMGCVRJTGJRSS-UHFFFAOYSA-NInChI: InChI=1S/C5H7N3S/c1-3-2-4(9)8-5(6)7-3/h2H,1H3,(H3,6,7,8,9)
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5-Methylpyrimidine-2,4(1H,3H)-dithioneCas Number: 6217-61-4 EC Number: ‘228-286-4Formula: C5H6N2S2 Molecular Weight: 158.2IUPAC Name: 5-methyl-1H-pyrimidine-2,4-dithioneSMILES: CC1=CNC(=S)NC1=SInChIKey: KQRLVMSUOWYRHL-UHFFFAOYSA-NInChI: InChI=1S/C5H6N2S2/c1-3-2-6-5(9)7-4(3)8/h2H,1H3,(H2,6,7,8,9)Synonyms: Dithiothymin | Dithiothymine | W17242 | SB56144 | AI3-52684 | (5-Methyl)dithiouracil | 5-Methyl-2,4-pyrimidinedithiol...
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Pyrimidine-4(3H)-thioneCas Number: 1450-86-8 Compound CID: 3978733Formula: C4H4N2S Molecular Weight: 112.16IUPAC Name: 1H-pyrimidine-6-thioneSMILES: C1=CN=CNC1=SInChIKey: MGAXHFMCFLLMNG-UHFFFAOYSA-NInChI: InChI=1S/C4H4N2S/c7-4-1-2-5-3-6-4/h1-3H,(H,5,6,7)Synonyms: GS-6212 | AMY11538 | AKOS016908479 | CS-0045757 | Pyrimidine-4(3H)-thione | AKOS025146908 | DTXSID70903817 | SCHEMBL1...
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4,5-Diamino-2,6-dimercaptopyrimidineCas Number: 31295-41-7Formula: C4H6N4S2 Molecular Weight: 174.25IUPAC Name: 5,6-diamino-1H-pyrimidine-2,4-dithioneSMILES: C1(=C(NC(=S)NC1=S)N)NInChIKey: IQGYCVKWCYGVBK-UHFFFAOYSA-NInChI: InChI=1S/C4H6N4S2/c5-1-2(6)7-4(10)8-3(1)9/h5H2,(H4,6,7,8,9,10)Synonyms: 5,6-Diamino-pyrimidine-2,4-dithiol | 5,6-Diaminopyrimidine-2,4-dithiol | FT-0646115 | 5,6-diamino-2,4-pyrimidinedithi...
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4,6-Diamino-2-mercaptopyrimidineCas Number: 1004-39-3Formula: C4H6N4S Molecular Weight: 142.18IUPAC Name: 4,6-diamino-1H-pyrimidine-2-thioneSMILES: C1=C(NC(=S)N=C1N)NInChIKey: QCAWOHUJKPKOMD-UHFFFAOYSA-NInChI: InChI=1S/C4H6N4S/c5-2-1-3(6)8-4(9)7-2/h1H,(H5,5,6,7,8,9)Synonyms: 4,6-Diamino-2-mercaptopyrimidine | 6-Amino-2-thiocytosine, 4,6-Diamino-2-pyrimidinethiol | 0VP6I0FY3O | 4,6-Diaminopy...
