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

Systemtic Name: N-(5-chloranyl-2-methyl-phenyl)-N-[2-oxidanylidene-2-[4-(phenylmethyl)piperazin-1-yl]ethyl]methanesulfonamide Openeye Name: N-[2-(4-benzylpiperazin-1-yl)-2-oxo-ethyl]-N-(5-chloro-2-methyl-phenyl)methanesulfonamide CAS Name: N-(5-chloro-2-methylphenyl)-N-[2-oxo-2-[4-(phenylmethyl)-1-piperazinyl]ethyl]methanesulfonamide IUPAC Name: N-[2-(4-benzylpiperazin-1-yl)-2-oxoethyl]-N-(5-chloro-2-methylphenyl)methanesulfonamide Traditional Name: N-[2-(4-benzylpiperazino)-2-keto-ethyl]-N-(5-chloro-2-methyl-phenyl)methanesulfonamide Formula: C21H26ClN3O3S MolecularWeight: 435.96744

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26ClN3O3S/c1-17-8-9-19(22)14-20(17)25(29(2,27)28)16-21(26)24-12-10-23(11-13-24)15-18-6-4-3-5-7-18/h3-9,14H,10-13,15-16H2,1-2H3