2-(2-methylphenyl)-N-[4-methylsulfanyl-1-(methylsulfonylamino)-1-oxidanylidene-butan-2-yl]-4-(pyridin-3-yloxymethyl)benzamide

Systemtic Name: 2-(2-methylphenyl)-N-[4-methylsulfanyl-1-(methylsulfonylamino)-1-oxidanylidene-butan-2-yl]-4-(pyridin-3-yloxymethyl)benzamide Openeye Name: N-[3-methylsulfanyl-1-(methylsulfonylcarbamoyl)propyl]-2-(o-tolyl)-4-(3-pyridyloxymethyl)benzamide CAS Name: N-[1-(methanesulfonamido)-4-(methylthio)-1-oxobutan-2-yl]-2-(2-methylphenyl)-4-(3-pyridinyloxymethyl)benzamide IUPAC Name: N-[1-(methanesulfonamido)-4-methylsulfanyl-1-oxobutan-2-yl]-2-(2-methylphenyl)-4-(pyridin-3-yloxymethyl)benzamide Traditional Name: N-[1-(mesylcarbamoyl)-3-(methylthio)propyl]-2-(o-tolyl)-4-(3-pyridyloxymethyl)benzamide Formula: C26H29N3O5S2 MolecularWeight: 527.65556

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=C(C=CC(=C2)COC3=CN=CC=C3)C(=O)NC(CCSC)C(=O)NS(=O)(=O)C

Isomeric SMILES

CC1=CC=CC=C1C2=C(C=CC(=C2)COC3=CN=CC=C3)C(=O)NC(CCSC)C(=O)NS(=O)(=O)C

InChI

InChI=1S/C26H29N3O5S2/c1-18-7-4-5-9-21(18)23-15-19(17-34-20-8-6-13-27-16-20)10-11-22(23)25(30)28-24(12-14-35-2)26(31)29-36(3,32)33/h4-11,13,15-16,24H,12,14,17H2,1-3H3,(H,28,30)(H,29,31)