2-[4-ethyl-5-(2-oxidanylidene-2-phenylazanyl-ethyl)sulfanyl-1,2,4-triazol-3-yl]-N-(4-fluorophenyl)ethanamide

Systemtic Name: 2-[4-ethyl-5-(2-oxidanylidene-2-phenylazanyl-ethyl)sulfanyl-1,2,4-triazol-3-yl]-N-(4-fluorophenyl)ethanamide Openeye Name: 2-[5-(2-anilino-2-oxo-ethyl)sulfanyl-4-ethyl-1,2,4-triazol-3-yl]-N-(4-fluorophenyl)acetamide CAS Name: 2-[5-[(2-anilino-2-oxoethyl)thio]-4-ethyl-1,2,4-triazol-3-yl]-N-(4-fluorophenyl)acetamide IUPAC Name: 2-[5-(2-anilino-2-oxoethyl)sulfanyl-4-ethyl-1,2,4-triazol-3-yl]-N-(4-fluorophenyl)acetamide Traditional Name: 2-[5-[(2-anilino-2-keto-ethyl)thio]-4-ethyl-1,2,4-triazol-3-yl]-N-(4-fluorophenyl)acetamide Formula: C20H20FN5O2S MolecularWeight: 413.468503

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC(=O)NC2=CC=CC=C2)CC(=O)NC3=CC=C(C=C3)F

Isomeric SMILES

CCN1C(=NN=C1SCC(=O)NC2=CC=CC=C2)CC(=O)NC3=CC=C(C=C3)F

InChI

InChI=1S/C20H20FN5O2S/c1-2-26-17(12-18(27)22-16-10-8-14(21)9-11-16)24-25-20(26)29-13-19(28)23-15-6-4-3-5-7-15/h3-11H,2,12-13H2,1H3,(H,22,27)(H,23,28)