2-[2-[(4-methylphenyl)-methylsulfonyl-amino]ethanoylamino]-N-(pyridin-3-ylmethyl)benzamide

Systemtic Name: 2-[2-[(4-methylphenyl)-methylsulfonyl-amino]ethanoylamino]-N-(pyridin-3-ylmethyl)benzamide Openeye Name: 2-[[2-(4-methyl-N-methylsulfonyl-anilino)acetyl]amino]-N-(3-pyridylmethyl)benzamide CAS Name: 2-[[2-(4-methyl-N-methylsulfonylanilino)-1-oxoethyl]amino]-N-(3-pyridinylmethyl)benzamide IUPAC Name: 2-[[2-(4-methyl-N-methylsulfonylanilino)acetyl]amino]-N-(pyridin-3-ylmethyl)benzamide Traditional Name: 2-[[2-(N-mesyl-4-methyl-anilino)acetyl]amino]-N-(3-pyridylmethyl)benzamide Formula: C23H24N4O4S MolecularWeight: 452.52606

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N(CC(=O)NC2=CC=CC=C2C(=O)NCC3=CN=CC=C3)S(=O)(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)N(CC(=O)NC2=CC=CC=C2C(=O)NCC3=CN=CC=C3)S(=O)(=O)C

InChI

InChI=1S/C23H24N4O4S/c1-17-9-11-19(12-10-17)27(32(2,30)31)16-22(28)26-21-8-4-3-7-20(21)23(29)25-15-18-6-5-13-24-14-18/h3-14H,15-16H2,1-2H3,(H,25,29)(H,26,28)