4-[[(3-methylphenyl)-methylsulfonyl-amino]methyl]-N-(pyridin-3-ylmethyl)benzamide

Systemtic Name: 4-[[(3-methylphenyl)-methylsulfonyl-amino]methyl]-N-(pyridin-3-ylmethyl)benzamide Openeye Name: 4-[(3-methyl-N-methylsulfonyl-anilino)methyl]-N-(3-pyridylmethyl)benzamide CAS Name: 4-[(3-methyl-N-methylsulfonylanilino)methyl]-N-(3-pyridinylmethyl)benzamide IUPAC Name: 4-[(3-methyl-N-methylsulfonylanilino)methyl]-N-(pyridin-3-ylmethyl)benzamide Traditional Name: 4-[(N-mesyl-3-methyl-anilino)methyl]-N-(3-pyridylmethyl)benzamide Formula: C22H23N3O3S MolecularWeight: 409.50132

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N(CC2=CC=C(C=C2)C(=O)NCC3=CN=CC=C3)S(=O)(=O)C

Isomeric SMILES

CC1=CC(=CC=C1)N(CC2=CC=C(C=C2)C(=O)NCC3=CN=CC=C3)S(=O)(=O)C

InChI

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