Vitas-M small molecule compound
ethyl 6-ethyl-2-{[(2-nitrophenyl)carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK442932
SMILES CCOC(=O)c1c(sc2c1CCC(C2)CC)NC(=O)c1ccccc1[N+](=O)[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 C20H22N2O5S MW 402.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N2O5S/c1-3-12-9-10-14-16(11-12)28-19(17(14)20(24)27-4-2)21-18(23)13-7-5-6-8-15(13)22(25)26/h5-8,12H,3-4,9-11H2,1-2H3,(H,21,23)InChIKey
JZXIJOYJQUFQQY-UHFFFAOYSA-NSynonyms
CCC1CCC2=C(C1)SC(=C2C(=O)OCC)NC(=O)C3=CC=CC=C3(N+)(=O)(O)
CCOC(=O)c1c(sc2c1CCC(C2)CC)NC(=O)c1ccccc1(N+)(=O)(O)
ethyl6ethyl2(((2nitrophenyl)carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
ethyl6ethyl2((2nitrobenzoyl)amino)4567tetrahydro1benzothiophene3carboxylate
InChI=1SC20H22N2O5Sc13129101416(1112)2819(17(14)20(24)2742)2118(23)13756815(13)22(25)26h5812H34911H212H3(H2123)
MFCD01354256
ZINC000004558420
ZINC000004558421
Check stock
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