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

Systemtic Name: N-[3-cyano-4-[1-[4-methyl-5-(4-methylphenyl)carbonyl-1H-pyrrol-2-yl]ethyl]phenyl]methanesulfonamide Openeye Name: N-[3-cyano-4-[1-[4-methyl-5-(4-methylbenzoyl)-1H-pyrrol-2-yl]ethyl]phenyl]methanesulfonamide CAS Name: N-[3-cyano-4-[1-[4-methyl-5-[(4-methylphenyl)-oxomethyl]-1H-pyrrol-2-yl]ethyl]phenyl]methanesulfonamide IUPAC Name: N-[3-cyano-4-[1-[4-methyl-5-(4-methylbenzoyl)-1H-pyrrol-2-yl]ethyl]phenyl]methanesulfonamide Traditional Name: N-[3-cyano-4-[1-(4-methyl-5-p-toluoyl-1H-pyrrol-2-yl)ethyl]phenyl]methanesulfonamide Formula: C23H23N3O3S MolecularWeight: 421.51202

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C2=C(C=C(N2)C(C)C3=C(C=C(C=C3)NS(=O)(=O)C)C#N)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C2=C(C=C(N2)C(C)C3=C(C=C(C=C3)NS(=O)(=O)C)C#N)C

InChI

InChI=1S/C23H23N3O3S/c1-14-5-7-17(8-6-14)23(27)22-15(2)11-21(25-22)16(3)20-10-9-19(12-18(20)13-24)26-30(4,28)29/h5-12,16,25-26H,1-4H3