Vitas-M small molecule compound
7-tert-butyl-2-[(3,3-dimethyl-2-oxobutyl)sulfanyl]-3-phenyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STK734393
SMILES O=c1n(c2ccccc2)c(SCC(=O)C(C)(C)C)nc2c1c1CCC(Cc1s2)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 C26H32N2O2S2 MW 468.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H32N2O2S2/c1-25(2,3)16-12-13-18-19(14-16)32-22-21(18)23(30)28(17-10-8-7-9-11-17)24(27-22)31-15-20(29)26(4,5)6/h7-11,16H,12-15H2,1-6H3InChIKey
AVNLTOCTUZVBFE-UHFFFAOYSA-NSynonyms
7tertbutyl2((33dimethyl2oxobutyl)sulfanyl)3phenyl5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
7tertbutyl2(33dimethyl2oxobutyl)sulfanyl3phenyl5678tetrahydro(1)benzothiolo(23d)pyrimidin4one
CC(C)(C)C1CCC2=C(C1)SC3=C2C(=O)N(C(=N3)SCC(=O)C(C)(C)C)C4=CC=CC=C4
InChI=1SC26H32N2O2S2c125(23)1612131819(1416)322221(18)23(30)28(17108791117)24(2722)311520(29)26(45)6h71116H1215H216H3
MFCD01926194
ZINC000008426322
ZINC000008426325
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