Vitas-M small molecule compound
7-tert-butyl-2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-3-phenyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STK522957
SMILES Clc1ccc(cc1)C(=O)CSc1nc2sc3c(c2c(=O)n1c1ccccc1)CCC(C3)C(C)(C)C
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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 C28H27ClN2O2S2 MW 523.12 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H27ClN2O2S2/c1-28(2,3)18-11-14-21-23(15-18)35-25-24(21)26(33)31(20-7-5-4-6-8-20)27(30-25)34-16-22(32)17-9-12-19(29)13-10-17/h4-10,12-13,18H,11,14-16H2,1-3H3InChIKey
PLHPUFDHARIESB-UHFFFAOYSA-NSynonyms
7tertbutyl2((2(4chlorophenyl)2oxoethyl)sulfanyl)3phenyl5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
7tertbutyl2(2(4chlorophenyl)2oxoethyl)sulfanyl3phenyl5678tetrahydro(1)benzothiolo(23d)pyrimidin4one
CC(C)(C)C1CCC2=C(C1)SC3=C2C(=O)N(C(=N3)SCC(=O)C4=CC=C(C=C4)Cl)C5=CC=CC=C5
InChI=1SC28H27ClN2O2S2c128(23)1811142123(1518)352524(21)26(33)31(207546820)27(3025)341622(32)1791219(29)131017h410121318H111416H213H3
MFCD01907400
ZINC000012364969
ZINC000012364970
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