N-(5-chloranyl-2-methyl-phenyl)-N-[4-oxidanylidene-4-(4-phenylpiperazin-1-yl)butyl]methanesulfonamide

Systemtic Name: N-(5-chloranyl-2-methyl-phenyl)-N-[4-oxidanylidene-4-(4-phenylpiperazin-1-yl)butyl]methanesulfonamide Openeye Name: N-(5-chloro-2-methyl-phenyl)-N-[4-oxo-4-(4-phenylpiperazin-1-yl)butyl]methanesulfonamide CAS Name: N-(5-chloro-2-methylphenyl)-N-[4-oxo-4-(4-phenyl-1-piperazinyl)butyl]methanesulfonamide IUPAC Name: N-(5-chloro-2-methylphenyl)-N-[4-oxo-4-(4-phenylpiperazin-1-yl)butyl]methanesulfonamide Traditional Name: N-(5-chloro-2-methyl-phenyl)-N-[4-keto-4-(4-phenylpiperazino)butyl]methanesulfonamide Formula: C22H28ClN3O3S MolecularWeight: 449.99402

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)N(CCCC(=O)N2CCN(CC2)C3=CC=CC=C3)S(=O)(=O)C

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)N(CCCC(=O)N2CCN(CC2)C3=CC=CC=C3)S(=O)(=O)C

InChI

InChI=1S/C22H28ClN3O3S/c1-18-10-11-19(23)17-21(18)26(30(2,28)29)12-6-9-22(27)25-15-13-24(14-16-25)20-7-4-3-5-8-20/h3-5,7-8,10-11,17H,6,9,12-16H2,1-2H3