N-[4-(4-methanoylpiperazin-1-yl)-4-oxidanylidene-butyl]-N-(3-methylphenyl)methanesulfonamide

Systemtic Name: N-[4-(4-methanoylpiperazin-1-yl)-4-oxidanylidene-butyl]-N-(3-methylphenyl)methanesulfonamide Openeye Name: N-[4-(4-formylpiperazin-1-yl)-4-oxo-butyl]-N-(m-tolyl)methanesulfonamide CAS Name: N-[4-(4-formyl-1-piperazinyl)-4-oxobutyl]-N-(3-methylphenyl)methanesulfonamide IUPAC Name: N-[4-(4-formylpiperazin-1-yl)-4-oxobutyl]-N-(3-methylphenyl)methanesulfonamide Traditional Name: N-[4-(4-formylpiperazino)-4-keto-butyl]-N-(m-tolyl)methanesulfonamide Formula: C17H25N3O4S MolecularWeight: 367.4631

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N(CCCC(=O)N2CCN(CC2)C=O)S(=O)(=O)C

Isomeric SMILES

CC1=CC(=CC=C1)N(CCCC(=O)N2CCN(CC2)C=O)S(=O)(=O)C

InChI

InChI=1S/C17H25N3O4S/c1-15-5-3-6-16(13-15)20(25(2,23)24)8-4-7-17(22)19-11-9-18(14-21)10-12-19/h3,5-6,13-14H,4,7-12H2,1-2H3