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

Systemtic Name: N-[1-(4-butylsulfonylpiperazin-1-yl)-3-(3-cyanophenyl)-1-oxidanylidene-propan-2-yl]naphthalene-2-sulfonamide Openeye Name: N-[2-(4-butylsulfonylpiperazin-1-yl)-1-[(3-cyanophenyl)methyl]-2-oxo-ethyl]naphthalene-2-sulfonamide CAS Name: N-[1-(4-butylsulfonyl-1-piperazinyl)-3-(3-cyanophenyl)-1-oxopropan-2-yl]-2-naphthalenesulfonamide IUPAC Name: N-[1-(4-butylsulfonylpiperazin-1-yl)-3-(3-cyanophenyl)-1-oxopropan-2-yl]naphthalene-2-sulfonamide Traditional Name: N-[2-(4-butylsulfonylpiperazino)-1-(3-cyanobenzyl)-2-keto-ethyl]naphthalene-2-sulfonamide Formula: C28H32N4O5S2 MolecularWeight: 568.70748

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)N1CCN(CC1)C(=O)C(CC2=CC=CC(=C2)C#N)NS(=O)(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

CCCCS(=O)(=O)N1CCN(CC1)C(=O)C(CC2=CC=CC(=C2)C#N)NS(=O)(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C28H32N4O5S2/c1-2-3-17-38(34,35)32-15-13-31(14-16-32)28(33)27(19-22-7-6-8-23(18-22)21-29)30-39(36,37)26-12-11-24-9-4-5-10-25(24)20-26/h4-12,18,20,27,30H,2-3,13-17,19H2,1H3