Vitas-M small molecule compound
ethyl 2-{[(4-nitrophenyl)carbonyl]amino}-7-oxo-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK280048
SMILES CCOC(=O)c1c(NC(=O)c2ccc(cc2)[N+](=O)[O-])sc2c1CCCC2=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 C18H16N2O6S MW 388.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16N2O6S/c1-2-26-18(23)14-12-4-3-5-13(21)15(12)27-17(14)19-16(22)10-6-8-11(9-7-10)20(24)25/h6-9H,2-5H2,1H3,(H,19,22)InChIKey
YNDUUNDQXJEZFB-UHFFFAOYSA-NSynonyms
329059-84-9329059849
CCOC(=O)C1=C(SC2=C1CCCC2=O)NC(=O)C3=CC=C(C=C3)(N+)(=O)(O)
CCOC(=O)c1c(NC(=O)c2ccc(cc2)(N+)(=O)(O))sc2c1CCCC2=O
ethyl2(((4nitrophenyl)carbonyl)amino)7oxo4567tetrahydro1benzothiophene3carboxylate
ETHYL2((4NITROBENZOYL)AMINO)7OXO56DIHYDRO4H1BENZOTHIOPHENE3CARBOXYLATE
ETHYL2((4NITROPHENYL)CARBONYLAMINO)7OXO456TRIHYDROBENZO(B)THIOPHENE3CARBOXYLATE
ethyl2(4nitrobenzamido)7oxo4567tetrahydrobenzo(b)thiophene3carboxylate
InChI=1SC18H16N2O6Sc122618(23)141243513(21)15(12)2717(14)1916(22)106811(9710)20(24)25h69H25H21H3(H1922)
MFCD00769526
ZINC000000846113
ZINC00846113
ZINC846113
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