Vitas-M small molecule compound
7-methyl-2-[(2-oxo-2-phenylethyl)sulfanyl]-3-(prop-2-en-1-yl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STK722759
SMILES C=CCn1c(SCC(=O)c2ccccc2)nc2c(c1=O)c1CCC(Cc1s2)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 C22H22N2O2S2 MW 410.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N2O2S2/c1-3-11-24-21(26)19-16-10-9-14(2)12-18(16)28-20(19)23-22(24)27-13-17(25)15-7-5-4-6-8-15/h3-8,14H,1,9-13H2,2H3InChIKey
AQADWEXATQDSMD-UHFFFAOYSA-NSynonyms
3allyl7methyl2((2oxo2phenylethyl)thio)5678tetrahydrobenzo(45)thieno(23d)pyrimidin4(3H)one
7methyl2((2oxo2phenylethyl)sulfanyl)3(prop2en1yl)5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
7methyl2phenacylsulfanyl3prop2enyl5678tetrahydro(1)benzothiolo(23d)pyrimidin4one
CC1CCC2=C(C1)SC3=C2C(=O)N(C(=N3)SCC(=O)C4=CC=CC=C4)CC=C
InChI=1SC22H22N2O2S2c13112421(26)191610914(2)1218(16)2820(19)2322(24)271317(25)157546815h3814H1913H22H3
MFCD02239898
ZINC000001033733
ZINC000004333739
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