Vitas-M small molecule compound
5-methyl-2-[(2-oxo-2-phenylethyl)sulfanyl]-3-phenyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STK996422
SMILES O=C(c1ccccc1)CSc1nc2sc3c(c2c(=O)n1c1ccccc1)C(C)CCC3
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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 C25H22N2O2S2 MW 446.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22N2O2S2/c1-16-9-8-14-20-21(16)22-23(31-20)26-25(27(24(22)29)18-12-6-3-7-13-18)30-15-19(28)17-10-4-2-5-11-17/h2-7,10-13,16H,8-9,14-15H2,1H3InChIKey
RKCCFSABTIORMY-UHFFFAOYSA-NSynonyms
5methyl2((2oxo2phenylethyl)sulfanyl)3phenyl5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
5methyl2phenacylsulfanyl3phenyl5678tetrahydro(1)benzothiolo(23d)pyrimidin4one
CC1CCCC2=C1C3=C(S2)N=C(N(C3=O)C4=CC=CC=C4)SCC(=O)C5=CC=CC=C5
InChI=1SC25H22N2O2S2c11698142021(16)2223(3120)2625(27(24(22)29)18126371318)301519(28)17104251117h27101316H891415H21H3
MFCD02236131
ZINC000009993250
ZINC000009993252
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