Vitas-M small molecule compound
N-[4-(acetylamino)phenyl]-2-{[4-oxo-3-(prop-2-en-1-yl)-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetamide
Catalog ID
STL294558
SMILES C=CCn1c(SCC(=O)Nc2ccc(cc2)NC(=O)C)nc2c(c1=O)c1CCCCc1s2
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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 C23H24N4O3S2 MW 468.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H24N4O3S2/c1-3-12-27-22(30)20-17-6-4-5-7-18(17)32-21(20)26-23(27)31-13-19(29)25-16-10-8-15(9-11-16)24-14(2)28/h3,8-11H,1,4-7,12-13H2,2H3,(H,24,28)(H,25,29)InChIKey
QXWSWVTYDGIEQQ-UHFFFAOYSA-NSynonyms
452923-31-8452923318
CC(=O)NC1=CC=C(C=C1)NC(=O)CSC2=NC3=C(C4=C(S3)CCCC4)C(=O)N2CC=C
InChI=1SC23H24N4O3S2c13122722(30)2017645718(17)3221(20)2623(27)311319(29)251610815(91116)2414(2)28h3811H1471213H22H3(H2428)(H2529)
MFCD02361454
N(4(acetylamino)phenyl)2((4oxo3(prop2en1yl)345678hexahydro(1)benzothieno(23d)pyrimidin2yl)sulfanyl)acetamide
N(4acetamidophenyl)2((3allyl4oxo345678hexahydrobenzo(45)thieno(23d)pyrimidin2yl)thio)acetamide
N(4acetamidophenyl)2((4oxo3prop2enyl5678tetrahydro(1)benzothiolo(23d)pyrimidin2yl)sulfanyl)acetamide
ZINC000000731760
ZINC00731760
ZINC731760
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