N-[[4-(4-methanoylpiperazin-1-yl)carbonylphenyl]methyl]-N-(3-methylphenyl)methanesulfonamide

Systemtic Name: N-[[4-(4-methanoylpiperazin-1-yl)carbonylphenyl]methyl]-N-(3-methylphenyl)methanesulfonamide Openeye Name: N-[[4-(4-formylpiperazine-1-carbonyl)phenyl]methyl]-N-(m-tolyl)methanesulfonamide CAS Name: N-[[4-[(4-formyl-1-piperazinyl)-oxomethyl]phenyl]methyl]-N-(3-methylphenyl)methanesulfonamide IUPAC Name: N-[[4-(4-formylpiperazine-1-carbonyl)phenyl]methyl]-N-(3-methylphenyl)methanesulfonamide Traditional Name: N-[4-(4-formylpiperazine-1-carbonyl)benzyl]-N-(m-tolyl)methanesulfonamide Formula: C21H25N3O4S MolecularWeight: 415.5059

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25N3O4S/c1-17-4-3-5-20(14-17)24(29(2,27)28)15-18-6-8-19(9-7-18)21(26)23-12-10-22(16-25)11-13-23/h3-9,14,16H,10-13,15H2,1-2H3