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

Systemtic Name: N-[(3-methylphenyl)-phenyl-methyl]-4-[(4-methylsulfonylpiperazin-1-yl)methyl]benzamide Openeye Name: 4-[(4-methylsulfonylpiperazin-1-yl)methyl]-N-[m-tolyl(phenyl)methyl]benzamide CAS Name: N-[(3-methylphenyl)-phenylmethyl]-4-[(4-methylsulfonyl-1-piperazinyl)methyl]benzamide IUPAC Name: N-[(3-methylphenyl)-phenylmethyl]-4-[(4-methylsulfonylpiperazin-1-yl)methyl]benzamide Traditional Name: 4-[(4-mesylpiperazino)methyl]-N-[m-tolyl(phenyl)methyl]benzamide Formula: C27H31N3O3S MolecularWeight: 477.61834

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)C(C2=CC=CC=C2)NC(=O)C3=CC=C(C=C3)CN4CCN(CC4)S(=O)(=O)C

Isomeric SMILES

CC1=CC(=CC=C1)C(C2=CC=CC=C2)NC(=O)C3=CC=C(C=C3)CN4CCN(CC4)S(=O)(=O)C

InChI

InChI=1S/C27H31N3O3S/c1-21-7-6-10-25(19-21)26(23-8-4-3-5-9-23)28-27(31)24-13-11-22(12-14-24)20-29-15-17-30(18-16-29)34(2,32)33/h3-14,19,26H,15-18,20H2,1-2H3,(H,28,31)