Vitas-M small molecule compound
N-(4-chloro-2-methoxy-5-methylphenyl)-2-{[3-(4-methoxyphenyl)-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetamide
Catalog ID
STL054081
SMILES COc1ccc(cc1)n1c(SCC(=O)Nc2cc(C)c(cc2OC)Cl)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 C27H26ClN3O4S2 MW 556.11 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26ClN3O4S2/c1-15-12-20(21(35-3)13-19(15)28)29-23(32)14-36-27-30-25-24(18-6-4-5-7-22(18)37-25)26(33)31(27)16-8-10-17(34-2)11-9-16/h8-13H,4-7,14H2,1-3H3,(H,29,32)InChIKey
ORVOMWUWYJJSGU-UHFFFAOYSA-NSynonyms
476485-63-9476485639
CC1=CC(=C(C=C1Cl)OC)NC(=O)CSC2=NC3=C(C4=C(S3)CCCC4)C(=O)N2C5=CC=C(C=C5)OC
InChI=1SC27H26ClN3O4S2c1151220(21(353)1319(15)28)2923(32)143627302524(18645722(18)3725)26(33)31(27)1681017(342)11916h813H4714H213H3(H2932)
MFCD03473825
N(4chloro2methoxy5methylphenyl)2((3(4methoxyphenyl)4oxo345678hexahydro(1)benzothieno(23d)pyrimidin2yl)sulfanyl)acetamide
N(4chloro2methoxy5methylphenyl)2((3(4methoxyphenyl)4oxo345678hexahydrobenzo(45)thieno(23d)pyrimidin2yl)thio)acetamide
N(4chloro2methoxy5methylphenyl)2((3(4methoxyphenyl)4oxo5678tetrahydro(1)benzothiolo(23d)pyrimidin2yl)sulfanyl)acetamide
ZINC000001815526
ZINC01815526
ZINC1815526
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