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

Systemtic Name: 3-[4-(phenylmethyl)piperazin-1-yl]sulfonyl-N-(3-pyrazol-1-ylpropyl)benzamide Openeye Name: 3-(4-benzylpiperazin-1-yl)sulfonyl-N-(3-pyrazol-1-ylpropyl)benzamide CAS Name: 3-[[4-(phenylmethyl)-1-piperazinyl]sulfonyl]-N-[3-(1-pyrazolyl)propyl]benzamide IUPAC Name: 3-(4-benzylpiperazin-1-yl)sulfonyl-N-(3-pyrazol-1-ylpropyl)benzamide Traditional Name: 3-(4-benzylpiperazino)sulfonyl-N-(3-pyrazol-1-ylpropyl)benzamide Formula: C24H29N5O3S MolecularWeight: 467.58376

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)NCCCN4C=CC=N4

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)S(=O)(=O)C3=CC=CC(=C3)C(=O)NCCCN4C=CC=N4

InChI

InChI=1S/C24H29N5O3S/c30-24(25-11-5-13-28-14-6-12-26-28)22-9-4-10-23(19-22)33(31,32)29-17-15-27(16-18-29)20-21-7-2-1-3-8-21/h1-4,6-10,12,14,19H,5,11,13,15-18,20H2,(H,25,30)