methyl 1-[2-oxidanylidene-2-[(3-pyrrolidin-1-ylsulfonylphenyl)amino]ethyl]indole-3-carboxylate

Systemtic Name: methyl 1-[2-oxidanylidene-2-[(3-pyrrolidin-1-ylsulfonylphenyl)amino]ethyl]indole-3-carboxylate Openeye Name: methyl 1-[2-oxo-2-(3-pyrrolidin-1-ylsulfonylanilino)ethyl]indole-3-carboxylate CAS Name: 1-[2-oxo-2-[3-(1-pyrrolidinylsulfonyl)anilino]ethyl]-3-indolecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-oxo-2-(3-pyrrolidin-1-ylsulfonylanilino)ethyl]indole-3-carboxylate Traditional Name: 1-[2-keto-2-(3-pyrrolidinosulfonylanilino)ethyl]indole-3-carboxylic acid methyl ester Formula: C22H23N3O5S MolecularWeight: 441.50012

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN(C2=CC=CC=C21)CC(=O)NC3=CC(=CC=C3)S(=O)(=O)N4CCCC4

Isomeric SMILES

COC(=O)C1=CN(C2=CC=CC=C21)CC(=O)NC3=CC(=CC=C3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C22H23N3O5S/c1-30-22(27)19-14-24(20-10-3-2-9-18(19)20)15-21(26)23-16-7-6-8-17(13-16)31(28,29)25-11-4-5-12-25/h2-3,6-10,13-14H,4-5,11-12,15H2,1H3,(H,23,26)