N-[[4-(3-methylpiperidin-1-yl)phenyl]methyl]-3-[(4-methylsulfonylpiperazin-1-yl)methyl]benzamide

Systemtic Name: N-[[4-(3-methylpiperidin-1-yl)phenyl]methyl]-3-[(4-methylsulfonylpiperazin-1-yl)methyl]benzamide Openeye Name: N-[[4-(3-methyl-1-piperidyl)phenyl]methyl]-3-[(4-methylsulfonylpiperazin-1-yl)methyl]benzamide CAS Name: N-[[4-(3-methyl-1-piperidinyl)phenyl]methyl]-3-[(4-methylsulfonyl-1-piperazinyl)methyl]benzamide IUPAC Name: N-[[4-(3-methylpiperidin-1-yl)phenyl]methyl]-3-[(4-methylsulfonylpiperazin-1-yl)methyl]benzamide Traditional Name: 3-[(4-mesylpiperazino)methyl]-N-[4-(3-methylpiperidino)benzyl]benzamide Formula: C26H36N4O3S MolecularWeight: 484.65404

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C2=CC=C(C=C2)CNC(=O)C3=CC(=CC=C3)CN4CCN(CC4)S(=O)(=O)C

Isomeric SMILES

CC1CCCN(C1)C2=CC=C(C=C2)CNC(=O)C3=CC(=CC=C3)CN4CCN(CC4)S(=O)(=O)C

InChI

InChI=1S/C26H36N4O3S/c1-21-5-4-12-29(19-21)25-10-8-22(9-11-25)18-27-26(31)24-7-3-6-23(17-24)20-28-13-15-30(16-14-28)34(2,32)33/h3,6-11,17,21H,4-5,12-16,18-20H2,1-2H3,(H,27,31)