N-[4-[4-(2,4-dimethylphenyl)piperazin-1-yl]carbonylphenyl]methanesulfonamide

Systemtic Name: N-[4-[4-(2,4-dimethylphenyl)piperazin-1-yl]carbonylphenyl]methanesulfonamide Openeye Name: N-[4-[4-(2,4-dimethylphenyl)piperazine-1-carbonyl]phenyl]methanesulfonamide CAS Name: N-[4-[[4-(2,4-dimethylphenyl)-1-piperazinyl]-oxomethyl]phenyl]methanesulfonamide IUPAC Name: N-[4-[4-(2,4-dimethylphenyl)piperazine-1-carbonyl]phenyl]methanesulfonamide Traditional Name: N-[4-[4-(2,4-dimethylphenyl)piperazine-1-carbonyl]phenyl]methanesulfonamide Formula: C20H25N3O3S MolecularWeight: 387.4958

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2CCN(CC2)C(=O)C3=CC=C(C=C3)NS(=O)(=O)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)N2CCN(CC2)C(=O)C3=CC=C(C=C3)NS(=O)(=O)C)C

InChI

InChI=1S/C20H25N3O3S/c1-15-4-9-19(16(2)14-15)22-10-12-23(13-11-22)20(24)17-5-7-18(8-6-17)21-27(3,25)26/h4-9,14,21H,10-13H2,1-3H3