N-[(2-fluorophenyl)carbamoyl]-2-[(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-[(2-fluorophenyl)carbamoyl]-2-[(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-[(2-fluorophenyl)carbamoyl]-2-[[5-(4-pyridyl)-1H-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-[(2-fluoroanilino)-oxomethyl]-2-[(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-[(2-fluorophenyl)carbamoyl]-2-[(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-[(2-fluorophenyl)carbamoyl]-2-[[5-(4-pyridyl)-1H-1,2,4-triazol-3-yl]thio]acetamide Formula: C16H13FN6O2S MolecularWeight: 372.376823

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NC(=O)NC(=O)CSC2=NNC(=N2)C3=CC=NC=C3)F

Isomeric SMILES

C1=CC=C(C(=C1)NC(=O)NC(=O)CSC2=NNC(=N2)C3=CC=NC=C3)F

InChI

InChI=1S/C16H13FN6O2S/c17-11-3-1-2-4-12(11)19-15(25)20-13(24)9-26-16-21-14(22-23-16)10-5-7-18-8-6-10/h1-8H,9H2,(H,21,22,23)(H2,19,20,24,25)