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

Systemtic Name: N-[4-[4-[(4-cyanophenyl)methyl]piperazin-1-yl]-4-oxidanylidene-butyl]naphthalene-2-sulfonamide Openeye Name: N-[4-[4-[(4-cyanophenyl)methyl]piperazin-1-yl]-4-oxo-butyl]naphthalene-2-sulfonamide CAS Name: N-[4-[4-[(4-cyanophenyl)methyl]-1-piperazinyl]-4-oxobutyl]-2-naphthalenesulfonamide IUPAC Name: N-[4-[4-[(4-cyanophenyl)methyl]piperazin-1-yl]-4-oxobutyl]naphthalene-2-sulfonamide Traditional Name: N-[4-[4-(4-cyanobenzyl)piperazino]-4-keto-butyl]naphthalene-2-sulfonamide Formula: C26H28N4O3S MolecularWeight: 476.59052

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H28N4O3S/c27-19-21-7-9-22(10-8-21)20-29-14-16-30(17-15-29)26(31)6-3-13-28-34(32,33)25-12-11-23-4-1-2-5-24(23)18-25/h1-2,4-5,7-12,18,28H,3,6,13-17,20H2