[2-[2-(1H-indol-3-yl)ethylamino]-2-oxidanylidene-ethyl] 4,5-dimethyl-2-pyrrol-1-yl-thiophene-3-carboxylate

Systemtic Name: [2-[2-(1H-indol-3-yl)ethylamino]-2-oxidanylidene-ethyl] 4,5-dimethyl-2-pyrrol-1-yl-thiophene-3-carboxylate Openeye Name: [2-[2-(1H-indol-3-yl)ethylamino]-2-oxo-ethyl] 4,5-dimethyl-2-pyrrol-1-yl-thiophene-3-carboxylate CAS Name: 4,5-dimethyl-2-(1-pyrrolyl)-3-thiophenecarboxylic acid [2-[2-(1H-indol-3-yl)ethylamino]-2-oxoethyl] ester IUPAC Name: [2-[2-(1H-indol-3-yl)ethylamino]-2-oxoethyl] 4,5-dimethyl-2-pyrrol-1-ylthiophene-3-carboxylate Traditional Name: 4,5-dimethyl-2-pyrrol-1-yl-thiophene-3-carboxylic acid [2-[2-(1H-indol-3-yl)ethylamino]-2-keto-ethyl] ester Formula: C23H23N3O3S MolecularWeight: 421.51202

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OCC(=O)NCCC2=CNC3=CC=CC=C32)N4C=CC=C4)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)OCC(=O)NCCC2=CNC3=CC=CC=C32)N4C=CC=C4)C

InChI

InChI=1S/C23H23N3O3S/c1-15-16(2)30-22(26-11-5-6-12-26)21(15)23(28)29-14-20(27)24-10-9-17-13-25-19-8-4-3-7-18(17)19/h3-8,11-13,25H,9-10,14H2,1-2H3,(H,24,27)