N-(2-ethoxyphenyl)-2-[(5-oxidanylidene-4-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]-2-phenyl-ethanamide

Systemtic Name: N-(2-ethoxyphenyl)-2-[(5-oxidanylidene-4-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]-2-phenyl-ethanamide Openeye Name: N-(2-ethoxyphenyl)-2-[(5-oxo-4-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]-2-phenyl-acetamide CAS Name: N-(2-ethoxyphenyl)-2-[(5-oxo-4-propyl-1H-1,2,4-triazol-3-yl)thio]-2-phenylacetamide IUPAC Name: N-(2-ethoxyphenyl)-2-[(5-oxo-4-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]-2-phenylacetamide Traditional Name: 2-[(5-keto-4-propyl-1H-1,2,4-triazol-3-yl)thio]-N-o-phenetyl-2-phenyl-acetamide Formula: C21H24N4O3S MolecularWeight: 412.50526

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)NN=C1SC(C2=CC=CC=C2)C(=O)NC3=CC=CC=C3OCC

Isomeric SMILES

CCCN1C(=O)NN=C1SC(C2=CC=CC=C2)C(=O)NC3=CC=CC=C3OCC

InChI

InChI=1S/C21H24N4O3S/c1-3-14-25-20(27)23-24-21(25)29-18(15-10-6-5-7-11-15)19(26)22-16-12-8-9-13-17(16)28-4-2/h5-13,18H,3-4,14H2,1-2H3,(H,22,26)(H,23,27)