N-[3-[4-[(4-cyanophenyl)methyl]piperazin-1-yl]-3-oxidanylidene-propyl]naphthalene-2-sulfonamide

Systemtic Name: N-[3-[4-[(4-cyanophenyl)methyl]piperazin-1-yl]-3-oxidanylidene-propyl]naphthalene-2-sulfonamide Openeye Name: N-[3-[4-[(4-cyanophenyl)methyl]piperazin-1-yl]-3-oxo-propyl]naphthalene-2-sulfonamide CAS Name: N-[3-[4-[(4-cyanophenyl)methyl]-1-piperazinyl]-3-oxopropyl]-2-naphthalenesulfonamide IUPAC Name: N-[3-[4-[(4-cyanophenyl)methyl]piperazin-1-yl]-3-oxopropyl]naphthalene-2-sulfonamide Traditional Name: N-[3-[4-(4-cyanobenzyl)piperazino]-3-keto-propyl]naphthalene-2-sulfonamide Formula: C25H26N4O3S MolecularWeight: 462.56394

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=C(C=C2)C#N)C(=O)CCNS(=O)(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

C1CN(CCN1CC2=CC=C(C=C2)C#N)C(=O)CCNS(=O)(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C25H26N4O3S/c26-18-20-5-7-21(8-6-20)19-28-13-15-29(16-14-28)25(30)11-12-27-33(31,32)24-10-9-22-3-1-2-4-23(22)17-24/h1-10,17,27H,11-16,19H2