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

Systemtic Name: 4-[[(3,4-dimethylphenyl)-methylsulfonyl-amino]methyl]-N-(pyridin-4-ylmethyl)benzamide Openeye Name: 4-[(3,4-dimethyl-N-methylsulfonyl-anilino)methyl]-N-(4-pyridylmethyl)benzamide CAS Name: 4-[(3,4-dimethyl-N-methylsulfonylanilino)methyl]-N-(pyridin-4-ylmethyl)benzamide IUPAC Name: 4-[(3,4-dimethyl-N-methylsulfonylanilino)methyl]-N-(pyridin-4-ylmethyl)benzamide Traditional Name: 4-[(N-mesyl-3,4-dimethyl-anilino)methyl]-N-(4-pyridylmethyl)benzamide Formula: C23H25N3O3S MolecularWeight: 423.5279

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H25N3O3S/c1-17-4-9-22(14-18(17)2)26(30(3,28)29)16-20-5-7-21(8-6-20)23(27)25-15-19-10-12-24-13-11-19/h4-14H,15-16H2,1-3H3,(H,25,27)