[2-[(1-methylpyrrol-2-yl)carbonylamino]-2-oxidanylidene-ethyl] 2-[(4-bromophenyl)sulfonylamino]ethanoate

Systemtic Name: [2-[(1-methylpyrrol-2-yl)carbonylamino]-2-oxidanylidene-ethyl] 2-[(4-bromophenyl)sulfonylamino]ethanoate Openeye Name: [2-[(1-methylpyrrole-2-carbonyl)amino]-2-oxo-ethyl] 2-[(4-bromophenyl)sulfonylamino]acetate CAS Name: 2-[(4-bromophenyl)sulfonylamino]acetic acid [2-[[(1-methyl-2-pyrrolyl)-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-[(1-methylpyrrole-2-carbonyl)amino]-2-oxoethyl] 2-[(4-bromophenyl)sulfonylamino]acetate Traditional Name: 2-(brosylamino)acetic acid [2-keto-2-[(1-methylpyrrole-2-carbonyl)amino]ethyl] ester Formula: C16H16BrN3O6S MolecularWeight: 458.28374

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C(=O)NC(=O)COC(=O)CNS(=O)(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

CN1C=CC=C1C(=O)NC(=O)COC(=O)CNS(=O)(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C16H16BrN3O6S/c1-20-8-2-3-13(20)16(23)19-14(21)10-26-15(22)9-18-27(24,25)12-6-4-11(17)5-7-12/h2-8,18H,9-10H2,1H3,(H,19,21,23)