N-[3-(3-cyanophenyl)-1-oxidanylidene-1-(4-phenylpiperazin-1-yl)propan-2-yl]naphthalene-2-sulfonamide

Systemtic Name: N-[3-(3-cyanophenyl)-1-oxidanylidene-1-(4-phenylpiperazin-1-yl)propan-2-yl]naphthalene-2-sulfonamide Openeye Name: N-[1-[(3-cyanophenyl)methyl]-2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]naphthalene-2-sulfonamide CAS Name: N-[3-(3-cyanophenyl)-1-oxo-1-(4-phenyl-1-piperazinyl)propan-2-yl]-2-naphthalenesulfonamide IUPAC Name: N-[3-(3-cyanophenyl)-1-oxo-1-(4-phenylpiperazin-1-yl)propan-2-yl]naphthalene-2-sulfonamide Traditional Name: N-[1-(3-cyanobenzyl)-2-keto-2-(4-phenylpiperazino)ethyl]naphthalene-2-sulfonamide Formula: C30H28N4O3S MolecularWeight: 524.63332

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C(=O)C(CC3=CC=CC(=C3)C#N)NS(=O)(=O)C4=CC5=CC=CC=C5C=C4

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C(=O)C(CC3=CC=CC(=C3)C#N)NS(=O)(=O)C4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C30H28N4O3S/c31-22-24-8-6-7-23(19-24)20-29(30(35)34-17-15-33(16-18-34)27-11-2-1-3-12-27)32-38(36,37)28-14-13-25-9-4-5-10-26(25)21-28/h1-14,19,21,29,32H,15-18,20H2