Vitas-M small molecule compound
N-(2,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl)-2-{[9-(4-methylphenyl)-6-oxo-6,9-dihydro-1H-purin-8-yl]sulfanyl}acetamide
Catalog ID
STK497078
SMILES Cc1ccc(cc1)n1c(SCC(=O)Nn2c(C)nc3c(c2=O)cc(s3)C)nc2c1nc[nH]c2=O
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C22H19N7O3S2 MW 493.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19N7O3S2/c1-11-4-6-14(7-5-11)28-18-17(19(31)24-10-23-18)26-22(28)33-9-16(30)27-29-13(3)25-20-15(21(29)32)8-12(2)34-20/h4-8,10H,9H2,1-3H3,(H,27,30)(H,23,24,31)InChIKey
QFSPGQWGDRFYQQ-UHFFFAOYSA-NSynonyms
CC1=CC=C(C=C1)N2C3=C(C(=O)N=CN3)N=C2SCC(=O)NN4C(=NC5=C(C4=O)C=C(S5)C)C
Cc1ccc(cc1)n1c(SCC(=O)Nn2c(C)nc3c(c2=O)cc(s3)C)nc2c1nc(nH)c2=O
InChI=1SC22H19N7O3S2c1114614(7511)281817(19(31)24102318)2622(28)33916(30)272913(3)252015(21(29)32)812(2)3420h4810H9H213H3(H2730)(H232431)
MFCD11854598
N(26dimethyl4oxothieno(23d)pyrimidin3(4H)yl)2((9(4methylphenyl)6oxo69dihydro1Hpurin8yl)sulfanyl)acetamide
N(26dimethyl4oxothieno(23d)pyrimidin3yl)2((9(4methylphenyl)6oxo3Hpurin8yl)sulfanyl)acetamide
ZINC000020394354
ZINC20394354
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