N-(2-cyanoethyl)-N-methyl-2-[3-(4-methylphenyl)sulfonylindol-1-yl]ethanamide

Systemtic Name: N-(2-cyanoethyl)-N-methyl-2-[3-(4-methylphenyl)sulfonylindol-1-yl]ethanamide Openeye Name: N-(2-cyanoethyl)-N-methyl-2-[3-(p-tolylsulfonyl)indol-1-yl]acetamide CAS Name: N-(2-cyanoethyl)-N-methyl-2-[3-(4-methylphenyl)sulfonyl-1-indolyl]acetamide IUPAC Name: N-(2-cyanoethyl)-N-methyl-2-[3-(4-methylphenyl)sulfonylindol-1-yl]acetamide Traditional Name: N-(2-cyanoethyl)-N-methyl-2-(3-tosylindol-1-yl)acetamide Formula: C21H21N3O3S MolecularWeight: 395.47474

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2=CN(C3=CC=CC=C32)CC(=O)N(C)CCC#N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2=CN(C3=CC=CC=C32)CC(=O)N(C)CCC#N

InChI

InChI=1S/C21H21N3O3S/c1-16-8-10-17(11-9-16)28(26,27)20-14-24(19-7-4-3-6-18(19)20)15-21(25)23(2)13-5-12-22/h3-4,6-11,14H,5,13,15H2,1-2H3