N-(2-methylbutan-2-yl)-3-[[4-(phenylsulfonyl)piperazin-1-yl]methyl]benzamide

Systemtic Name: N-(2-methylbutan-2-yl)-3-[[4-(phenylsulfonyl)piperazin-1-yl]methyl]benzamide Openeye Name: 3-[[4-(benzenesulfonyl)piperazin-1-yl]methyl]-N-(1,1-dimethylpropyl)benzamide CAS Name: 3-[[4-(benzenesulfonyl)-1-piperazinyl]methyl]-N-(2-methylbutan-2-yl)benzamide IUPAC Name: 3-[[4-(benzenesulfonyl)piperazin-1-yl]methyl]-N-(2-methylbutan-2-yl)benzamide Traditional Name: N-tert-amyl-3-[(4-besylpiperazino)methyl]benzamide Formula: C23H31N3O3S MolecularWeight: 429.57554

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)NC(=O)C1=CC(=CC=C1)CN2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CCC(C)(C)NC(=O)C1=CC(=CC=C1)CN2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C23H31N3O3S/c1-4-23(2,3)24-22(27)20-10-8-9-19(17-20)18-25-13-15-26(16-14-25)30(28,29)21-11-6-5-7-12-21/h5-12,17H,4,13-16,18H2,1-3H3,(H,24,27)