N-(3-phenylpropyl)-4-[[4-(phenylsulfonyl)piperazin-1-yl]methyl]benzamide

Systemtic Name: N-(3-phenylpropyl)-4-[[4-(phenylsulfonyl)piperazin-1-yl]methyl]benzamide Openeye Name: 4-[[4-(benzenesulfonyl)piperazin-1-yl]methyl]-N-(3-phenylpropyl)benzamide CAS Name: 4-[[4-(benzenesulfonyl)-1-piperazinyl]methyl]-N-(3-phenylpropyl)benzamide IUPAC Name: 4-[[4-(benzenesulfonyl)piperazin-1-yl]methyl]-N-(3-phenylpropyl)benzamide Traditional Name: 4-[(4-besylpiperazino)methyl]-N-(3-phenylpropyl)benzamide Formula: C27H31N3O3S MolecularWeight: 477.61834

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=C(C=C2)C(=O)NCCCC3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1CC2=CC=C(C=C2)C(=O)NCCCC3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C27H31N3O3S/c31-27(28-17-7-10-23-8-3-1-4-9-23)25-15-13-24(14-16-25)22-29-18-20-30(21-19-29)34(32,33)26-11-5-2-6-12-26/h1-6,8-9,11-16H,7,10,17-22H2,(H,28,31)