N-(2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)-2-[5-(trifluoromethyl)pyridin-2-yl]sulfanyl-propanamide

Systemtic Name: N-(2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)-2-[5-(trifluoromethyl)pyridin-2-yl]sulfanyl-propanamide Openeye Name: N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-2-[[5-(trifluoromethyl)-2-pyridyl]sulfanyl]propanamide CAS Name: N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-2-[[5-(trifluoromethyl)-2-pyridinyl]thio]propanamide IUPAC Name: N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-2-[5-(trifluoromethyl)pyridin-2-yl]sulfanylpropanamide Traditional Name: N-(2-keto-1,3-dihydrobenzimidazol-5-yl)-2-[[5-(trifluoromethyl)-2-pyridyl]thio]propionamide Formula: C16H13F3N4O2S MolecularWeight: 382.36023

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC2=C(C=C1)NC(=O)N2)SC3=NC=C(C=C3)C(F)(F)F

Isomeric SMILES

CC(C(=O)NC1=CC2=C(C=C1)NC(=O)N2)SC3=NC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C16H13F3N4O2S/c1-8(26-13-5-2-9(7-20-13)16(17,18)19)14(24)21-10-3-4-11-12(6-10)23-15(25)22-11/h2-8H,1H3,(H,21,24)(H2,22,23,25)