4-[(4-methylphenyl)methyl-methylsulfonyl-amino]-N-(pyridin-4-ylmethyl)benzamide

Systemtic Name: 4-[(4-methylphenyl)methyl-methylsulfonyl-amino]-N-(pyridin-4-ylmethyl)benzamide Openeye Name: 4-[methylsulfonyl(p-tolylmethyl)amino]-N-(4-pyridylmethyl)benzamide CAS Name: 4-[(4-methylphenyl)methyl-methylsulfonylamino]-N-(pyridin-4-ylmethyl)benzamide IUPAC Name: 4-[(4-methylphenyl)methyl-methylsulfonylamino]-N-(pyridin-4-ylmethyl)benzamide Traditional Name: 4-[mesyl-(4-methylbenzyl)amino]-N-(4-pyridylmethyl)benzamide Formula: C22H23N3O3S MolecularWeight: 409.50132

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN(C2=CC=C(C=C2)C(=O)NCC3=CC=NC=C3)S(=O)(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)CN(C2=CC=C(C=C2)C(=O)NCC3=CC=NC=C3)S(=O)(=O)C

InChI

InChI=1S/C22H23N3O3S/c1-17-3-5-19(6-4-17)16-25(29(2,27)28)21-9-7-20(8-10-21)22(26)24-15-18-11-13-23-14-12-18/h3-14H,15-16H2,1-2H3,(H,24,26)