2-[[6-(4-chlorophenyl)-7-oxidanylidene-1H-[1,2,4]triazolo[4,3-b][1,2,4]triazin-3-yl]sulfanyl]-N-(4-methoxyphenyl)ethanamide

Systemtic Name: 2-[[6-(4-chlorophenyl)-7-oxidanylidene-1H-[1,2,4]triazolo[4,3-b][1,2,4]triazin-3-yl]sulfanyl]-N-(4-methoxyphenyl)ethanamide Openeye Name: 2-[[6-(4-chlorophenyl)-7-oxo-1H-[1,2,4]triazolo[4,3-b][1,2,4]triazin-3-yl]sulfanyl]-N-(4-methoxyphenyl)acetamide CAS Name: 2-[[6-(4-chlorophenyl)-7-oxo-1H-[1,2,4]triazolo[4,3-b][1,2,4]triazin-3-yl]thio]-N-(4-methoxyphenyl)acetamide IUPAC Name: 2-[[6-(4-chlorophenyl)-7-oxo-1H-[1,2,4]triazolo[4,3-b][1,2,4]triazin-3-yl]sulfanyl]-N-(4-methoxyphenyl)acetamide Traditional Name: 2-[[6-(4-chlorophenyl)-7-keto-1H-[1,2,4]triazolo[4,3-b][1,2,4]triazin-3-yl]thio]-N-(4-methoxyphenyl)acetamide Formula: C19H15ClN6O3S MolecularWeight: 442.8788

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)CSC2=NNC3=NC(=O)C(=NN32)C4=CC=C(C=C4)Cl

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)CSC2=NNC3=NC(=O)C(=NN32)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C19H15ClN6O3S/c1-29-14-8-6-13(7-9-14)21-15(27)10-30-19-24-23-18-22-17(28)16(25-26(18)19)11-2-4-12(20)5-3-11/h2-9H,10H2,1H3,(H,21,27)(H,22,23,28)