2,5-dimethyl-N-[4-(4-phenylpiperazin-1-yl)carbonylphenyl]benzenesulfonamide

Systemtic Name: 2,5-dimethyl-N-[4-(4-phenylpiperazin-1-yl)carbonylphenyl]benzenesulfonamide Openeye Name: 2,5-dimethyl-N-[4-(4-phenylpiperazine-1-carbonyl)phenyl]benzenesulfonamide CAS Name: 2,5-dimethyl-N-[4-[oxo-(4-phenyl-1-piperazinyl)methyl]phenyl]benzenesulfonamide IUPAC Name: 2,5-dimethyl-N-[4-(4-phenylpiperazine-1-carbonyl)phenyl]benzenesulfonamide Traditional Name: 2,5-dimethyl-N-[4-(4-phenylpiperazine-1-carbonyl)phenyl]benzenesulfonamide Formula: C25H27N3O3S MolecularWeight: 449.56518

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)NC2=CC=C(C=C2)C(=O)N3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)NC2=CC=C(C=C2)C(=O)N3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C25H27N3O3S/c1-19-8-9-20(2)24(18-19)32(30,31)26-22-12-10-21(11-13-22)25(29)28-16-14-27(15-17-28)23-6-4-3-5-7-23/h3-13,18,26H,14-17H2,1-2H3