methyl 1-[2-[[3-(methylsulfonylamino)phenyl]methylamino]-2-oxidanylidene-ethyl]indole-3-carboxylate

Systemtic Name: methyl 1-[2-[[3-(methylsulfonylamino)phenyl]methylamino]-2-oxidanylidene-ethyl]indole-3-carboxylate Openeye Name: methyl 1-[2-[[3-(methanesulfonamido)phenyl]methylamino]-2-oxo-ethyl]indole-3-carboxylate CAS Name: 1-[2-[[3-(methanesulfonamido)phenyl]methylamino]-2-oxoethyl]-3-indolecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-[[3-(methanesulfonamido)phenyl]methylamino]-2-oxoethyl]indole-3-carboxylate Traditional Name: 1-[2-keto-2-[[3-(methanesulfonamido)benzyl]amino]ethyl]indole-3-carboxylic acid methyl ester Formula: C20H21N3O5S MolecularWeight: 415.46284

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN(C2=CC=CC=C21)CC(=O)NCC3=CC(=CC=C3)NS(=O)(=O)C

Isomeric SMILES

COC(=O)C1=CN(C2=CC=CC=C21)CC(=O)NCC3=CC(=CC=C3)NS(=O)(=O)C

InChI

InChI=1S/C20H21N3O5S/c1-28-20(25)17-12-23(18-9-4-3-8-16(17)18)13-19(24)21-11-14-6-5-7-15(10-14)22-29(2,26)27/h3-10,12,22H,11,13H2,1-2H3,(H,21,24)