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

Systemtic Name: N-[(2R)-3-(3-cyanophenyl)-1-(4-methylpiperazin-1-yl)-1-oxidanylidene-propan-2-yl]naphthalene-2-sulfonamide Openeye Name: N-[(1R)-1-[(3-cyanophenyl)methyl]-2-(4-methylpiperazin-1-yl)-2-oxo-ethyl]naphthalene-2-sulfonamide CAS Name: N-[(2R)-3-(3-cyanophenyl)-1-(4-methyl-1-piperazinyl)-1-oxopropan-2-yl]-2-naphthalenesulfonamide IUPAC Name: N-[(2R)-3-(3-cyanophenyl)-1-(4-methylpiperazin-1-yl)-1-oxopropan-2-yl]naphthalene-2-sulfonamide Traditional Name: N-[(1R)-1-(3-cyanobenzyl)-2-keto-2-(4-methylpiperazino)ethyl]naphthalene-2-sulfonamide Formula: C25H26N4O3S MolecularWeight: 462.56394

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)C(CC2=CC=CC(=C2)C#N)NS(=O)(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

CN1CCN(CC1)C(=O)[C@@H](CC2=CC=CC(=C2)C#N)NS(=O)(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C25H26N4O3S/c1-28-11-13-29(14-12-28)25(30)24(16-19-5-4-6-20(15-19)18-26)27-33(31,32)23-10-9-21-7-2-3-8-22(21)17-23/h2-10,15,17,24,27H,11-14,16H2,1H3/t24-/m1/s1