Vitas-M small molecule compound
2-{[3-(4-methoxyphenyl)-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}-N,N-diphenylacetamide
Catalog ID
STK542274
SMILES COc1ccc(cc1)n1c(SCC(=O)N(c2ccccc2)c2ccccc2)nc2c(c1=O)c1CCCCc1s2
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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 C31H27N3O3S2 MW 553.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H27N3O3S2/c1-37-24-18-16-23(17-19-24)34-30(36)28-25-14-8-9-15-26(25)39-29(28)32-31(34)38-20-27(35)33(21-10-4-2-5-11-21)22-12-6-3-7-13-22/h2-7,10-13,16-19H,8-9,14-15,20H2,1H3InChIKey
YOCHQHPZUXYRQZ-UHFFFAOYSA-NSynonyms
2((3(4methoxyphenyl)4oxo345678hexahydro(1)benzothieno(23d)pyrimidin2yl)sulfanyl)NNdiphenylacetamide
2((3(4methoxyphenyl)4oxo345678hexahydrobenzo(45)thieno(23d)pyrimidin2yl)thio)NNdiphenylacetamide
2((3(4methoxyphenyl)4oxo5678tetrahydro(1)benzothiolo(23d)pyrimidin2yl)sulfanyl)NNdiphenylacetamide
COC1=CC=C(C=C1)N2C(=O)C3=C(N=C2SCC(=O)N(C4=CC=CC=C4)C5=CC=CC=C5)SC6=C3CCCC6
InChI=1SC31H27N3O3S2c13724181623(171924)3430(36)282514891526(25)3929(28)3231(34)382027(35)33(21104251121)22126371322h2710131619H89141520H21H3
MFCD03303065
ZINC000001804513
ZINC01804513
ZINC1804513
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