N-(2,4-dimethylpentan-3-yl)-3-[[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methyl]benzamide

Systemtic Name: N-(2,4-dimethylpentan-3-yl)-3-[[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methyl]benzamide Openeye Name: N-(1-isopropyl-2-methyl-propyl)-3-[[4-(p-tolylsulfonyl)piperazin-1-yl]methyl]benzamide CAS Name: N-(2,4-dimethylpentan-3-yl)-3-[[4-(4-methylphenyl)sulfonyl-1-piperazinyl]methyl]benzamide IUPAC Name: N-(2,4-dimethylpentan-3-yl)-3-[[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methyl]benzamide Traditional Name: N-(1-isopropyl-2-methyl-propyl)-3-[(4-tosylpiperazino)methyl]benzamide Formula: C26H37N3O3S MolecularWeight: 471.65528

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=CC=CC(=C3)C(=O)NC(C(C)C)C(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=CC=CC(=C3)C(=O)NC(C(C)C)C(C)C

InChI

InChI=1S/C26H37N3O3S/c1-19(2)25(20(3)4)27-26(30)23-8-6-7-22(17-23)18-28-13-15-29(16-14-28)33(31,32)24-11-9-21(5)10-12-24/h6-12,17,19-20,25H,13-16,18H2,1-5H3,(H,27,30)