2,5-dimethyl-N-[3-oxidanylidene-3-(4-phenylpiperazin-1-yl)propyl]benzenesulfonamide

Systemtic Name: 2,5-dimethyl-N-[3-oxidanylidene-3-(4-phenylpiperazin-1-yl)propyl]benzenesulfonamide Openeye Name: 2,5-dimethyl-N-[3-oxo-3-(4-phenylpiperazin-1-yl)propyl]benzenesulfonamide CAS Name: 2,5-dimethyl-N-[3-oxo-3-(4-phenyl-1-piperazinyl)propyl]benzenesulfonamide IUPAC Name: 2,5-dimethyl-N-[3-oxo-3-(4-phenylpiperazin-1-yl)propyl]benzenesulfonamide Traditional Name: N-[3-keto-3-(4-phenylpiperazino)propyl]-2,5-dimethyl-benzenesulfonamide Formula: C21H27N3O3S MolecularWeight: 401.52238

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)NCCC(=O)N2CCN(CC2)C3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)NCCC(=O)N2CCN(CC2)C3=CC=CC=C3

InChI

InChI=1S/C21H27N3O3S/c1-17-8-9-18(2)20(16-17)28(26,27)22-11-10-21(25)24-14-12-23(13-15-24)19-6-4-3-5-7-19/h3-9,16,22H,10-15H2,1-2H3