N-(4-aminocarbonylphenyl)-3-[4-(phenylmethyl)piperazin-1-yl]sulfonyl-benzamide

Systemtic Name: N-(4-aminocarbonylphenyl)-3-[4-(phenylmethyl)piperazin-1-yl]sulfonyl-benzamide Openeye Name: 3-(4-benzylpiperazin-1-yl)sulfonyl-N-(4-carbamoylphenyl)benzamide CAS Name: N-(4-carbamoylphenyl)-3-[[4-(phenylmethyl)-1-piperazinyl]sulfonyl]benzamide IUPAC Name: 3-(4-benzylpiperazin-1-yl)sulfonyl-N-(4-carbamoylphenyl)benzamide Traditional Name: 3-(4-benzylpiperazino)sulfonyl-N-(4-carbamoylphenyl)benzamide Formula: C25H26N4O4S MolecularWeight: 478.56334

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)NC4=CC=C(C=C4)C(=O)N

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)S(=O)(=O)C3=CC=CC(=C3)C(=O)NC4=CC=C(C=C4)C(=O)N

InChI

InChI=1S/C25H26N4O4S/c26-24(30)20-9-11-22(12-10-20)27-25(31)21-7-4-8-23(17-21)34(32,33)29-15-13-28(14-16-29)18-19-5-2-1-3-6-19/h1-12,17H,13-16,18H2,(H2,26,30)(H,27,31)