4-[[[3-(2-ethoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]amino]methylidene]cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[[[3-(2-ethoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]amino]methylidene]cyclohexa-2,5-dien-1-one Openeye Name: 4-[[[3-(2-ethoxyphenyl)-5-thioxo-1H-1,2,4-triazol-4-yl]amino]methylene]cyclohexa-2,5-dien-1-one CAS Name: 4-[[[3-(2-ethoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]amino]methylidene]-1-cyclohexa-2,5-dienone IUPAC Name: 4-[[[3-(2-ethoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]amino]methylidene]cyclohexa-2,5-dien-1-one Traditional Name: 4-[[(3-o-phenetyl-5-thioxo-1H-1,2,4-triazol-4-yl)amino]methylene]cyclohexa-2,5-dien-1-one Formula: C17H16N4O2S MolecularWeight: 340.39954

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C2=NNC(=S)N2NC=C3C=CC(=O)C=C3

Isomeric SMILES

CCOC1=CC=CC=C1C2=NNC(=S)N2NC=C3C=CC(=O)C=C3

InChI

InChI=1S/C17H16N4O2S/c1-2-23-15-6-4-3-5-14(15)16-19-20-17(24)21(16)18-11-12-7-9-13(22)10-8-12/h3-11,18H,2H2,1H3,(H,20,24)