3-[[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methyl]-N-(4-propan-2-yloxyphenyl)benzamide

Systemtic Name: 3-[[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methyl]-N-(4-propan-2-yloxyphenyl)benzamide Openeye Name: N-(4-isopropoxyphenyl)-3-[[4-(p-tolylsulfonyl)piperazin-1-yl]methyl]benzamide CAS Name: 3-[[4-(4-methylphenyl)sulfonyl-1-piperazinyl]methyl]-N-(4-propan-2-yloxyphenyl)benzamide IUPAC Name: 3-[[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methyl]-N-(4-propan-2-yloxyphenyl)benzamide Traditional Name: N-(4-isopropoxyphenyl)-3-[(4-tosylpiperazino)methyl]benzamide Formula: C28H33N3O4S MolecularWeight: 507.64432

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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)NC4=CC=C(C=C4)OC(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=CC=CC(=C3)C(=O)NC4=CC=C(C=C4)OC(C)C

InChI

InChI=1S/C28H33N3O4S/c1-21(2)35-26-11-9-25(10-12-26)29-28(32)24-6-4-5-23(19-24)20-30-15-17-31(18-16-30)36(33,34)27-13-7-22(3)8-14-27/h4-14,19,21H,15-18,20H2,1-3H3,(H,29,32)