Vitas-M small molecule compound
methyl 2-{[(4-oxo-4H-chromen-2-yl)carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK516763
SMILES COC(=O)c1c(NC(=O)c2cc(=O)c3c(o2)cccc3)sc2c1CCCC2
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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 C20H17NO5S MW 383.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17NO5S/c1-25-20(24)17-12-7-3-5-9-16(12)27-19(17)21-18(23)15-10-13(22)11-6-2-4-8-14(11)26-15/h2,4,6,8,10H,3,5,7,9H2,1H3,(H,21,23)InChIKey
CIWORNCPGPYYPH-UHFFFAOYSA-NSynonyms
897840-04-9897840049
COC(=O)C1=C(SC2=C1CCCC2)NC(=O)C3=CC(=O)C4=CC=CC=C4O3
InChI=1SC20H17NO5Sc12520(24)1712735916(12)2719(17)2118(23)151013(22)11624814(11)2615h246810H3579H21H3(H2123)
methyl2(((4oxo4Hchromen2yl)carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
methyl2((4oxochromene2carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
MFCD08548710
ZINC000012062610
ZINC12062610
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