N-(3-chloranyl-4-methyl-phenyl)-4-[methylsulfonyl(phenyl)amino]butanamide

Systemtic Name: N-(3-chloranyl-4-methyl-phenyl)-4-[methylsulfonyl(phenyl)amino]butanamide Openeye Name: N-(3-chloro-4-methyl-phenyl)-4-(N-methylsulfonylanilino)butanamide CAS Name: N-(3-chloro-4-methylphenyl)-4-(N-methylsulfonylanilino)butanamide IUPAC Name: N-(3-chloro-4-methylphenyl)-4-(N-methylsulfonylanilino)butanamide Traditional Name: N-(3-chloro-4-methyl-phenyl)-4-(N-mesylanilino)butyramide Formula: C18H21ClN2O3S MolecularWeight: 380.88894

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CCCN(C2=CC=CC=C2)S(=O)(=O)C)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CCCN(C2=CC=CC=C2)S(=O)(=O)C)Cl

InChI

InChI=1S/C18H21ClN2O3S/c1-14-10-11-15(13-17(14)19)20-18(22)9-6-12-21(25(2,23)24)16-7-4-3-5-8-16/h3-5,7-8,10-11,13H,6,9,12H2,1-2H3,(H,20,22)