Vitas-M small molecule compound
2-{[3-(4-bromophenyl)-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}-N-(4-phenoxyphenyl)acetamide
Catalog ID
STK060141
SMILES O=C(Nc1ccc(cc1)Oc1ccccc1)CSc1nc2sc3c(c2c(=O)n1c1ccc(cc1)Br)CCCC3
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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 C30H24BrN3O3S2 MW 618.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H24BrN3O3S2/c31-19-10-14-21(15-11-19)34-29(36)27-24-8-4-5-9-25(24)39-28(27)33-30(34)38-18-26(35)32-20-12-16-23(17-13-20)37-22-6-2-1-3-7-22/h1-3,6-7,10-17H,4-5,8-9,18H2,(H,32,35)InChIKey
CQFBRNLVCZFOEC-UHFFFAOYSA-NSynonyms
2((3(4bromophenyl)4oxo345678hexahydro(1)benzothieno(23d)pyrimidin2yl)sulfanyl)N(4phenoxyphenyl)acetamide
2((3(4bromophenyl)4oxo345678hexahydrobenzo(45)thieno(23d)pyrimidin2yl)thio)N(4phenoxyphenyl)acetamide
2((3(4bromophenyl)4oxo5678tetrahydro(1)benzothiolo(23d)pyrimidin2yl)sulfanyl)N(4phenoxyphenyl)acetamide
C1CCC2=C(C1)C3=C(S2)N=C(N(C3=O)C4=CC=C(C=C4)Br)SCC(=O)NC5=CC=C(C=C5)OC6=CC=CC=C6
InChI=1SC30H24BrN3O3S2c3119101421(151119)3429(36)2724845925(24)3928(27)3330(34)381826(35)3220121623(171320)37226213722h13671017H458918H2(H3235)
MFCD03223106
O=C(Nc1ccc(cc1)Oc1ccccc1)CSc1nc2sc3c(c2c(=O)n1c1ccc(cc1)Br)CCCC3
STK060141
ZINC000100735935
ZINC100735935
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