(2S)-3-(1H-indol-3-yl)-2-[(3-methylphenyl)sulfonylamino]-N-prop-2-ynyl-propanamide

Systemtic Name: (2S)-3-(1H-indol-3-yl)-2-[(3-methylphenyl)sulfonylamino]-N-prop-2-ynyl-propanamide Openeye Name: (2S)-3-(1H-indol-3-yl)-2-(m-tolylsulfonylamino)-N-prop-2-ynyl-propanamide CAS Name: (2S)-3-(1H-indol-3-yl)-2-[(3-methylphenyl)sulfonylamino]-N-prop-2-ynylpropanamide IUPAC Name: (2S)-3-(1H-indol-3-yl)-2-[(3-methylphenyl)sulfonylamino]-N-prop-2-ynylpropanamide Traditional Name: (2S)-3-(1H-indol-3-yl)-2-(m-tolylsulfonylamino)-N-propargyl-propionamide Formula: C21H21N3O3S MolecularWeight: 395.47474

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)S(=O)(=O)NC(CC2=CNC3=CC=CC=C32)C(=O)NCC#C

Isomeric SMILES

CC1=CC(=CC=C1)S(=O)(=O)N[C@@H](CC2=CNC3=CC=CC=C32)C(=O)NCC#C

InChI

InChI=1S/C21H21N3O3S/c1-3-11-22-21(25)20(13-16-14-23-19-10-5-4-9-18(16)19)24-28(26,27)17-8-6-7-15(2)12-17/h1,4-10,12,14,20,23-24H,11,13H2,2H3,(H,22,25)/t20-/m0/s1