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

Systemtic Name: 3-[[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methyl]-N-[(3-propan-2-yloxyphenyl)methyl]benzamide Openeye Name: N-[(3-isopropoxyphenyl)methyl]-3-[[4-(p-tolylsulfonyl)piperazin-1-yl]methyl]benzamide CAS Name: 3-[[4-(4-methylphenyl)sulfonyl-1-piperazinyl]methyl]-N-[(3-propan-2-yloxyphenyl)methyl]benzamide IUPAC Name: 3-[[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methyl]-N-[(3-propan-2-yloxyphenyl)methyl]benzamide Traditional Name: N-(3-isopropoxybenzyl)-3-[(4-tosylpiperazino)methyl]benzamide Formula: C29H35N3O4S MolecularWeight: 521.6709

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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)NCC4=CC(=CC=C4)OC(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=CC=CC(=C3)C(=O)NCC4=CC(=CC=C4)OC(C)C

InChI

InChI=1S/C29H35N3O4S/c1-22(2)36-27-9-5-6-24(19-27)20-30-29(33)26-8-4-7-25(18-26)21-31-14-16-32(17-15-31)37(34,35)28-12-10-23(3)11-13-28/h4-13,18-19,22H,14-17,20-21H2,1-3H3,(H,30,33)