4-[[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methyl]-N-(pyridin-4-ylmethyl)benzamide

Systemtic Name: 4-[[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methyl]-N-(pyridin-4-ylmethyl)benzamide Openeye Name: 4-[[4-(p-tolylsulfonyl)piperazin-1-yl]methyl]-N-(4-pyridylmethyl)benzamide CAS Name: 4-[[4-(4-methylphenyl)sulfonyl-1-piperazinyl]methyl]-N-(pyridin-4-ylmethyl)benzamide IUPAC Name: 4-[[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methyl]-N-(pyridin-4-ylmethyl)benzamide Traditional Name: N-(4-pyridylmethyl)-4-[(4-tosylpiperazino)methyl]benzamide Formula: C25H28N4O3S MolecularWeight: 464.57982

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H28N4O3S/c1-20-2-8-24(9-3-20)33(31,32)29-16-14-28(15-17-29)19-22-4-6-23(7-5-22)25(30)27-18-21-10-12-26-13-11-21/h2-13H,14-19H2,1H3,(H,27,30)