Vitas-M small molecule compound
methyl 2-{[(2-nitrophenyl)carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK002453
SMILES COC(=O)c1c(sc2c1CCCC2)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 C17H16N2O5S MW 360.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16N2O5S/c1-24-17(21)14-11-7-3-5-9-13(11)25-16(14)18-15(20)10-6-2-4-8-12(10)19(22)23/h2,4,6,8H,3,5,7,9H2,1H3,(H,18,20)InChIKey
COTHJVVAZMHQTJ-UHFFFAOYSA-NSynonyms
314282-96-7314282967
COC(=O)C1=C(SC2=C1CCCC2)NC(=O)C3=CC=CC=C3(N+)(=O)(O)
COC(=O)c1c(sc2c1CCCC2)NC(=O)c1ccccc1(N+)(=O)(O)
InChI=1SC17H16N2O5Sc12417(21)1411735913(11)2516(14)1815(20)10624812(10)19(22)23h2468H3579H21H3(H1820)
methyl2(((2nitrophenyl)carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
methyl2((2nitrobenzoyl)amino)4567tetrahydro1benzothiophene3carboxylate
MFCD01163446
STK002453
ZINC000000687041
ZINC00687041
ZINC687041
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Check stock on Vitas-MAvailable files
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