4-ethanoyl-N-[3-oxidanylidene-3-(4-phenylpiperazin-1-yl)propyl]benzenesulfonamide

Systemtic Name: 4-ethanoyl-N-[3-oxidanylidene-3-(4-phenylpiperazin-1-yl)propyl]benzenesulfonamide Openeye Name: 4-acetyl-N-[3-oxo-3-(4-phenylpiperazin-1-yl)propyl]benzenesulfonamide CAS Name: 4-acetyl-N-[3-oxo-3-(4-phenyl-1-piperazinyl)propyl]benzenesulfonamide IUPAC Name: 4-acetyl-N-[3-oxo-3-(4-phenylpiperazin-1-yl)propyl]benzenesulfonamide Traditional Name: 4-acetyl-N-[3-keto-3-(4-phenylpiperazino)propyl]benzenesulfonamide Formula: C21H25N3O4S MolecularWeight: 415.5059

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25N3O4S/c1-17(25)18-7-9-20(10-8-18)29(27,28)22-12-11-21(26)24-15-13-23(14-16-24)19-5-3-2-4-6-19/h2-10,22H,11-16H2,1H3