2-(6-acetamidopyridin-3-yl)sulfanyl-N-[4-(trifluoromethyloxy)phenyl]benzamide

Systemtic Name: 2-(6-acetamidopyridin-3-yl)sulfanyl-N-[4-(trifluoromethyloxy)phenyl]benzamide Openeye Name: 2-[(6-acetamido-3-pyridyl)sulfanyl]-N-[4-(trifluoromethoxy)phenyl]benzamide CAS Name: 2-[(6-acetamido-3-pyridinyl)thio]-N-[4-(trifluoromethoxy)phenyl]benzamide IUPAC Name: 2-(6-acetamidopyridin-3-yl)sulfanyl-N-[4-(trifluoromethoxy)phenyl]benzamide Traditional Name: 2-[(6-acetamido-3-pyridyl)thio]-N-[4-(trifluoromethoxy)phenyl]benzamide Formula: C21H16F3N3O3S MolecularWeight: 447.43025

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NC=C(C=C1)SC2=CC=CC=C2C(=O)NC3=CC=C(C=C3)OC(F)(F)F

Isomeric SMILES

CC(=O)NC1=NC=C(C=C1)SC2=CC=CC=C2C(=O)NC3=CC=C(C=C3)OC(F)(F)F

InChI

InChI=1S/C21H16F3N3O3S/c1-13(28)26-19-11-10-16(12-25-19)31-18-5-3-2-4-17(18)20(29)27-14-6-8-15(9-7-14)30-21(22,23)24/h2-12H,1H3,(H,27,29)(H,25,26,28)