N-(3-chloranyl-4-cyano-phenyl)-3-[(4-methylphenyl)-(phenylsulfonyl)amino]propanamide

Systemtic Name: N-(3-chloranyl-4-cyano-phenyl)-3-[(4-methylphenyl)-(phenylsulfonyl)amino]propanamide Openeye Name: 3-[N-(benzenesulfonyl)-4-methyl-anilino]-N-(3-chloro-4-cyano-phenyl)propanamide CAS Name: 3-[N-(benzenesulfonyl)-4-methylanilino]-N-(3-chloro-4-cyanophenyl)propanamide IUPAC Name: 3-[N-(benzenesulfonyl)-4-methylanilino]-N-(3-chloro-4-cyanophenyl)propanamide Traditional Name: 3-(N-besyl-4-methyl-anilino)-N-(3-chloro-4-cyano-phenyl)propionamide Formula: C23H20ClN3O3S MolecularWeight: 453.9412

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N(CCC(=O)NC2=CC(=C(C=C2)C#N)Cl)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)N(CCC(=O)NC2=CC(=C(C=C2)C#N)Cl)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C23H20ClN3O3S/c1-17-7-11-20(12-8-17)27(31(29,30)21-5-3-2-4-6-21)14-13-23(28)26-19-10-9-18(16-25)22(24)15-19/h2-12,15H,13-14H2,1H3,(H,26,28)