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

Systemtic Name: 3-[4-(phenylmethyl)piperazin-1-yl]sulfonyl-N-quinolin-2-yl-benzamide Openeye Name: 3-(4-benzylpiperazin-1-yl)sulfonyl-N-(2-quinolyl)benzamide CAS Name: 3-[[4-(phenylmethyl)-1-piperazinyl]sulfonyl]-N-(2-quinolinyl)benzamide IUPAC Name: 3-(4-benzylpiperazin-1-yl)sulfonyl-N-quinolin-2-ylbenzamide Traditional Name: 3-(4-benzylpiperazino)sulfonyl-N-(2-quinolyl)benzamide Formula: C27H26N4O3S MolecularWeight: 486.58534

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)S(=O)(=O)C3=CC=CC(=C3)C(=O)NC4=NC5=CC=CC=C5C=C4

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)S(=O)(=O)C3=CC=CC(=C3)C(=O)NC4=NC5=CC=CC=C5C=C4

InChI

InChI=1S/C27H26N4O3S/c32-27(29-26-14-13-22-9-4-5-12-25(22)28-26)23-10-6-11-24(19-23)35(33,34)31-17-15-30(16-18-31)20-21-7-2-1-3-8-21/h1-14,19H,15-18,20H2,(H,28,29,32)