3-[4-(phenylmethyl)piperazin-1-yl]sulfonyl-N-(2-pyridin-2-ylethyl)benzamide

Systemtic Name: 3-[4-(phenylmethyl)piperazin-1-yl]sulfonyl-N-(2-pyridin-2-ylethyl)benzamide Openeye Name: 3-(4-benzylpiperazin-1-yl)sulfonyl-N-[2-(2-pyridyl)ethyl]benzamide CAS Name: 3-[[4-(phenylmethyl)-1-piperazinyl]sulfonyl]-N-[2-(2-pyridinyl)ethyl]benzamide IUPAC Name: 3-(4-benzylpiperazin-1-yl)sulfonyl-N-(2-pyridin-2-ylethyl)benzamide Traditional Name: 3-(4-benzylpiperazino)sulfonyl-N-[2-(2-pyridyl)ethyl]benzamide Formula: C25H28N4O3S MolecularWeight: 464.57982

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)S(=O)(=O)C3=CC=CC(=C3)C(=O)NCCC4=CC=CC=N4

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)S(=O)(=O)C3=CC=CC(=C3)C(=O)NCCC4=CC=CC=N4

InChI

InChI=1S/C25H28N4O3S/c30-25(27-14-12-23-10-4-5-13-26-23)22-9-6-11-24(19-22)33(31,32)29-17-15-28(16-18-29)20-21-7-2-1-3-8-21/h1-11,13,19H,12,14-18,20H2,(H,27,30)