Vitas-M small molecule compound
7-tert-butyl-3-(4-methylphenyl)-2-[(2-oxo-2-phenylethyl)sulfanyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STK722344
SMILES Cc1ccc(cc1)n1c(SCC(=O)c2ccccc2)nc2c(c1=O)c1CCC(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 C29H30N2O2S2 MW 502.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H30N2O2S2/c1-18-10-13-21(14-11-18)31-27(33)25-22-15-12-20(29(2,3)4)16-24(22)35-26(25)30-28(31)34-17-23(32)19-8-6-5-7-9-19/h5-11,13-14,20H,12,15-17H2,1-4H3InChIKey
SAPXDMDGQIFEKM-UHFFFAOYSA-NSynonyms
351160-07-1351160071
7(tertbutyl)2((2oxo2phenylethyl)thio)3(ptolyl)5678tetrahydrobenzo(45)thieno(23d)pyrimidin4(3H)one
7tertbutyl3(4methylphenyl)2((2oxo2phenylethyl)sulfanyl)5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
7tertbutyl3(4methylphenyl)2phenacylsulfanyl5678tetrahydro(1)benzothiolo(23d)pyrimidin4one
CC1=CC=C(C=C1)N2C(=O)C3=C(N=C2SCC(=O)C4=CC=CC=C4)SC5=C3CCC(C5)C(C)(C)C
InChI=1SC29H30N2O2S2c118101321(141118)3127(33)2522151220(29(23)4)1624(22)3526(25)3028(31)341723(32)198657919h511131420H121517H214H3
MFCD01874901
ZINC000002270584
ZINC000002270585
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