4-[[(3-ethyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)amino]methylidene]-2,6-dimethoxy-cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[[(3-ethyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)amino]methylidene]-2,6-dimethoxy-cyclohexa-2,5-dien-1-one Openeye Name: 4-[[(3-ethyl-5-thioxo-1H-1,2,4-triazol-4-yl)amino]methylene]-2,6-dimethoxy-cyclohexa-2,5-dien-1-one CAS Name: 4-[[(3-ethyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)amino]methylidene]-2,6-dimethoxy-1-cyclohexa-2,5-dienone IUPAC Name: 4-[[(3-ethyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)amino]methylidene]-2,6-dimethoxycyclohexa-2,5-dien-1-one Traditional Name: 4-[[(3-ethyl-5-thioxo-1H-1,2,4-triazol-4-yl)amino]methylene]-2,6-dimethoxy-cyclohexa-2,5-dien-1-one Formula: C13H16N4O3S MolecularWeight: 308.35614

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NNC(=S)N1NC=C2C=C(C(=O)C(=C2)OC)OC

Isomeric SMILES

CCC1=NNC(=S)N1NC=C2C=C(C(=O)C(=C2)OC)OC

InChI

InChI=1S/C13H16N4O3S/c1-4-11-15-16-13(21)17(11)14-7-8-5-9(19-2)12(18)10(6-8)20-3/h5-7,14H,4H2,1-3H3,(H,16,21)