Vitas-M small molecule compound
2-{[6-methyl-3-(4-methylphenyl)-4-oxo-4,5-dihydro-3H-pyrrolo[3,2-d]pyrimidin-2-yl]sulfanyl}-N-[2-(thiophen-2-yl)ethyl]acetamide
Catalog ID
STL093877
SMILES O=C(CSc1nc2cc([nH]c2c(=O)n1c1ccc(cc1)C)C)NCCc1cccs1
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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 C22H22N4O2S2 MW 438.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N4O2S2/c1-14-5-7-16(8-6-14)26-21(28)20-18(12-15(2)24-20)25-22(26)30-13-19(27)23-10-9-17-4-3-11-29-17/h3-8,11-12,24H,9-10,13H2,1-2H3,(H,23,27)InChIKey
OKGLRPPYGIJEEI-UHFFFAOYSA-NSynonyms
2((6methyl3(4methylphenyl)4oxo45dihydro3Hpyrrolo(32d)pyrimidin2yl)sulfanyl)N(2(thiophen2yl)ethyl)acetamide
2((6methyl3(4methylphenyl)4oxo5Hpyrrolo(32d)pyrimidin2yl)sulfanyl)N(2thiophen2ylethyl)acetamide
CC1=CC=C(C=C1)N2C(=O)C3=C(C=C(N3)C)N=C2SCC(=O)NCCC4=CC=CS4
InChI=1SC22H22N4O2S2c1145716(8614)2621(28)2018(1215(2)2420)2522(26)301319(27)231091743112917h38111224H91013H212H3(H2327)
MFCD18788011
O=C(CSc1nc2cc((nH)c2c(=O)n1c1ccc(cc1)C)C)NCCc1cccs1
ZINC000067239427
ZINC67239427
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