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

Systemtic Name: N-[3-(3-cyanophenyl)-1-(4-methylsulfonylpiperazin-1-yl)-1-oxidanylidene-propan-2-yl]naphthalene-1-sulfonamide Openeye Name: N-[1-[(3-cyanophenyl)methyl]-2-(4-methylsulfonylpiperazin-1-yl)-2-oxo-ethyl]naphthalene-1-sulfonamide CAS Name: N-[3-(3-cyanophenyl)-1-(4-methylsulfonyl-1-piperazinyl)-1-oxopropan-2-yl]-1-naphthalenesulfonamide IUPAC Name: N-[3-(3-cyanophenyl)-1-(4-methylsulfonylpiperazin-1-yl)-1-oxopropan-2-yl]naphthalene-1-sulfonamide Traditional Name: N-[1-(3-cyanobenzyl)-2-keto-2-(4-mesylpiperazino)ethyl]naphthalene-1-sulfonamide Formula: C25H26N4O5S2 MolecularWeight: 526.62774

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCN(CC1)C(=O)C(CC2=CC=CC(=C2)C#N)NS(=O)(=O)C3=CC=CC4=CC=CC=C43

Isomeric SMILES

CS(=O)(=O)N1CCN(CC1)C(=O)C(CC2=CC=CC(=C2)C#N)NS(=O)(=O)C3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C25H26N4O5S2/c1-35(31,32)29-14-12-28(13-15-29)25(30)23(17-19-6-4-7-20(16-19)18-26)27-36(33,34)24-11-5-9-21-8-2-3-10-22(21)24/h2-11,16,23,27H,12-15,17H2,1H3