2-[[4-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-oxidanylidene-1H-1,2,4-triazol-3-yl]sulfanyl]-N-phenyl-ethanamide

Systemtic Name: 2-[[4-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-oxidanylidene-1H-1,2,4-triazol-3-yl]sulfanyl]-N-phenyl-ethanamide Openeye Name: 2-[[4-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-oxo-1H-1,2,4-triazol-3-yl]sulfanyl]-N-phenyl-acetamide CAS Name: 2-[[4-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-oxo-1H-1,2,4-triazol-3-yl]thio]-N-phenylacetamide IUPAC Name: 2-[[4-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-oxo-1H-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide Traditional Name: 2-[[4-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-keto-1H-1,2,4-triazol-3-yl]thio]-N-phenyl-acetamide Formula: C18H16N4O4S MolecularWeight: 384.40904

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)N3C(=O)NN=C3SCC(=O)NC4=CC=CC=C4

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)N3C(=O)NN=C3SCC(=O)NC4=CC=CC=C4

InChI

InChI=1S/C18H16N4O4S/c23-16(19-12-4-2-1-3-5-12)11-27-18-21-20-17(24)22(18)13-6-7-14-15(10-13)26-9-8-25-14/h1-7,10H,8-9,11H2,(H,19,23)(H,20,24)