N-(3,4-dimethylphenyl)-N-[[4-[4-(2-fluorophenyl)piperazin-1-yl]carbonylphenyl]methyl]methanesulfonamide

Systemtic Name: N-(3,4-dimethylphenyl)-N-[[4-[4-(2-fluorophenyl)piperazin-1-yl]carbonylphenyl]methyl]methanesulfonamide Openeye Name: N-(3,4-dimethylphenyl)-N-[[4-[4-(2-fluorophenyl)piperazine-1-carbonyl]phenyl]methyl]methanesulfonamide CAS Name: N-(3,4-dimethylphenyl)-N-[[4-[[4-(2-fluorophenyl)-1-piperazinyl]-oxomethyl]phenyl]methyl]methanesulfonamide IUPAC Name: N-(3,4-dimethylphenyl)-N-[[4-[4-(2-fluorophenyl)piperazine-1-carbonyl]phenyl]methyl]methanesulfonamide Traditional Name: N-(3,4-dimethylphenyl)-N-[4-[4-(2-fluorophenyl)piperazine-1-carbonyl]benzyl]methanesulfonamide Formula: C27H30FN3O3S MolecularWeight: 495.608803

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N(CC2=CC=C(C=C2)C(=O)N3CCN(CC3)C4=CC=CC=C4F)S(=O)(=O)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)N(CC2=CC=C(C=C2)C(=O)N3CCN(CC3)C4=CC=CC=C4F)S(=O)(=O)C)C

InChI

InChI=1S/C27H30FN3O3S/c1-20-8-13-24(18-21(20)2)31(35(3,33)34)19-22-9-11-23(12-10-22)27(32)30-16-14-29(15-17-30)26-7-5-4-6-25(26)28/h4-13,18H,14-17,19H2,1-3H3