N-(cyanomethyl)-3-(1H-indol-3-yl)-2-(quinolin-6-ylsulfonylamino)propanamide

Systemtic Name: N-(cyanomethyl)-3-(1H-indol-3-yl)-2-(quinolin-6-ylsulfonylamino)propanamide Openeye Name: N-(cyanomethyl)-3-(1H-indol-3-yl)-2-(6-quinolylsulfonylamino)propanamide CAS Name: N-(cyanomethyl)-3-(1H-indol-3-yl)-2-(6-quinolinylsulfonylamino)propanamide IUPAC Name: N-(cyanomethyl)-3-(1H-indol-3-yl)-2-(quinolin-6-ylsulfonylamino)propanamide Traditional Name: N-(cyanomethyl)-3-(1H-indol-3-yl)-2-(6-quinolylsulfonylamino)propionamide Formula: C22H19N5O3S MolecularWeight: 433.48296

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)CC(C(=O)NCC#N)NS(=O)(=O)C3=CC4=C(C=C3)N=CC=C4

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)CC(C(=O)NCC#N)NS(=O)(=O)C3=CC4=C(C=C3)N=CC=C4

InChI

InChI=1S/C22H19N5O3S/c23-9-11-25-22(28)21(13-16-14-26-20-6-2-1-5-18(16)20)27-31(29,30)17-7-8-19-15(12-17)4-3-10-24-19/h1-8,10,12,14,21,26-27H,11,13H2,(H,25,28)