3-(1-ethanimidoylpiperidin-4-yl)-N-[2-(methylamino)phenyl]-N-(phenylmethyl)benzenesulfonamide

Systemtic Name: 3-(1-ethanimidoylpiperidin-4-yl)-N-[2-(methylamino)phenyl]-N-(phenylmethyl)benzenesulfonamide Openeye Name: N-benzyl-3-(1-ethanimidoyl-4-piperidyl)-N-[2-(methylamino)phenyl]benzenesulfonamide CAS Name: 3-[1-(1-iminoethyl)-4-piperidinyl]-N-[2-(methylamino)phenyl]-N-(phenylmethyl)benzenesulfonamide IUPAC Name: N-benzyl-3-(1-ethanimidoylpiperidin-4-yl)-N-[2-(methylamino)phenyl]benzenesulfonamide Traditional Name: 3-(1-acetimidoyl-4-piperidyl)-N-benzyl-N-[2-(methylamino)phenyl]benzenesulfonamide Formula: C27H32N4O2S MolecularWeight: 476.63358

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Descriptors Computed from Structure

Canonical SMILES:

CC(=N)N1CCC(CC1)C2=CC(=CC=C2)S(=O)(=O)N(CC3=CC=CC=C3)C4=CC=CC=C4NC

Isomeric SMILES

CC(=N)N1CCC(CC1)C2=CC(=CC=C2)S(=O)(=O)N(CC3=CC=CC=C3)C4=CC=CC=C4NC

InChI

InChI=1S/C27H32N4O2S/c1-21(28)30-17-15-23(16-18-30)24-11-8-12-25(19-24)34(32,33)31(20-22-9-4-3-5-10-22)27-14-7-6-13-26(27)29-2/h3-14,19,23,28-29H,15-18,20H2,1-2H3