N-(5-chloranyl-2-methyl-phenyl)-N-[1-oxidanylidene-1-[4-(phenylmethyl)piperazin-1-yl]propan-2-yl]methanesulfonamide

Systemtic Name: N-(5-chloranyl-2-methyl-phenyl)-N-[1-oxidanylidene-1-[4-(phenylmethyl)piperazin-1-yl]propan-2-yl]methanesulfonamide Openeye Name: N-[2-(4-benzylpiperazin-1-yl)-1-methyl-2-oxo-ethyl]-N-(5-chloro-2-methyl-phenyl)methanesulfonamide CAS Name: N-(5-chloro-2-methylphenyl)-N-[1-oxo-1-[4-(phenylmethyl)-1-piperazinyl]propan-2-yl]methanesulfonamide IUPAC Name: N-[1-(4-benzylpiperazin-1-yl)-1-oxopropan-2-yl]-N-(5-chloro-2-methylphenyl)methanesulfonamide Traditional Name: N-[2-(4-benzylpiperazino)-2-keto-1-methyl-ethyl]-N-(5-chloro-2-methyl-phenyl)methanesulfonamide Formula: C22H28ClN3O3S MolecularWeight: 449.99402

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)N(C(C)C(=O)N2CCN(CC2)CC3=CC=CC=C3)S(=O)(=O)C

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)N(C(C)C(=O)N2CCN(CC2)CC3=CC=CC=C3)S(=O)(=O)C

InChI

InChI=1S/C22H28ClN3O3S/c1-17-9-10-20(23)15-21(17)26(30(3,28)29)18(2)22(27)25-13-11-24(12-14-25)16-19-7-5-4-6-8-19/h4-10,15,18H,11-14,16H2,1-3H3