Vitas-M small molecule compound
ethyl {[7-methyl-4-oxo-3-(prop-2-en-1-yl)-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetate
Catalog ID
STK722753
SMILES C=CCn1c(SCC(=O)OCC)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 C18H22N2O3S2 MW 378.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H22N2O3S2/c1-4-8-20-17(22)15-12-7-6-11(3)9-13(12)25-16(15)19-18(20)24-10-14(21)23-5-2/h4,11H,1,5-10H2,2-3H3InChIKey
OGIZGPKPJLQQCV-UHFFFAOYSA-NSynonyms
CCOC(=O)CSC1=NC2=C(C3=C(S2)CC(CC3)C)C(=O)N1CC=C
ethyl((7methyl4oxo3(prop2en1yl)345678hexahydro(1)benzothieno(23d)pyrimidin2yl)sulfanyl)acetate
ethyl2((3allyl7methyl4oxo345678hexahydrobenzo(45)thieno(23d)pyrimidin2yl)thio)acetate
ethyl2((7methyl4oxo3prop2enyl5678tetrahydro(1)benzothiolo(23d)pyrimidin2yl)sulfanyl)acetate
InChI=1SC18H22N2O3S2c1482017(22)15127611(3)913(12)2516(15)1918(20)241014(21)2352h411H1510H223H3
MFCD02242217
ZINC000000985945
ZINC000000985946
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