N-[3-cyano-4-[[1-methyl-5-(4-methylphenyl)carbonyl-pyrrol-2-yl]methyl]phenyl]methanesulfonamide

Systemtic Name: N-[3-cyano-4-[[1-methyl-5-(4-methylphenyl)carbonyl-pyrrol-2-yl]methyl]phenyl]methanesulfonamide Openeye Name: N-[3-cyano-4-[[1-methyl-5-(4-methylbenzoyl)pyrrol-2-yl]methyl]phenyl]methanesulfonamide CAS Name: N-[3-cyano-4-[[1-methyl-5-[(4-methylphenyl)-oxomethyl]-2-pyrrolyl]methyl]phenyl]methanesulfonamide IUPAC Name: N-[3-cyano-4-[[1-methyl-5-(4-methylbenzoyl)pyrrol-2-yl]methyl]phenyl]methanesulfonamide Traditional Name: N-[3-cyano-4-[(1-methyl-5-p-toluoyl-pyrrol-2-yl)methyl]phenyl]methanesulfonamide Formula: C22H21N3O3S MolecularWeight: 407.48544

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C2=CC=C(N2C)CC3=C(C=C(C=C3)NS(=O)(=O)C)C#N

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C2=CC=C(N2C)CC3=C(C=C(C=C3)NS(=O)(=O)C)C#N

InChI

InChI=1S/C22H21N3O3S/c1-15-4-6-16(7-5-15)22(26)21-11-10-20(25(21)2)13-17-8-9-19(12-18(17)14-23)24-29(3,27)28/h4-12,24H,13H2,1-3H3