Vitas-M small molecule compound
methyl 6-ethyl-2-{[(2-oxo-2H-chromen-3-yl)carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK432287
SMILES CCC1CCc2c(C1)sc(c2C(=O)OC)NC(=O)c1cc2ccccc2oc1=O
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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 C22H21NO5S MW 411.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21NO5S/c1-3-12-8-9-14-17(10-12)29-20(18(14)22(26)27-2)23-19(24)15-11-13-6-4-5-7-16(13)28-21(15)25/h4-7,11-12H,3,8-10H2,1-2H3,(H,23,24)InChIKey
BFWXLKOQVSRNCN-UHFFFAOYSA-NSynonyms
CCC1CCC2=C(C1)SC(=C2C(=O)OC)NC(=O)C3=CC4=CC=CC=C4OC3=O
InChI=1SC22H21NO5Sc1312891417(1012)2920(18(14)22(26)272)2319(24)151113645716(13)2821(15)25h471112H3810H212H3(H2324)
methyl6ethyl2(((2oxo2Hchromen3yl)carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
methyl6ethyl2((2oxochromene3carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
MFCD03383889
ZINC000000656897
ZINC000000656898
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