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

Systemtic Name: 4-[[(3-cyclopropyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)amino]methylidene]-2-ethoxy-cyclohexa-2,5-dien-1-one Openeye Name: 4-[[(3-cyclopropyl-5-thioxo-1H-1,2,4-triazol-4-yl)amino]methylene]-2-ethoxy-cyclohexa-2,5-dien-1-one CAS Name: 4-[[(3-cyclopropyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)amino]methylidene]-2-ethoxy-1-cyclohexa-2,5-dienone IUPAC Name: 4-[[(3-cyclopropyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)amino]methylidene]-2-ethoxycyclohexa-2,5-dien-1-one Traditional Name: 4-[[(3-cyclopropyl-5-thioxo-1H-1,2,4-triazol-4-yl)amino]methylene]-2-ethoxy-cyclohexa-2,5-dien-1-one Formula: C14H16N4O2S MolecularWeight: 304.36744

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CNN2C(=NNC2=S)C3CC3)C=CC1=O

Isomeric SMILES

CCOC1=CC(=CNN2C(=NNC2=S)C3CC3)C=CC1=O

InChI

InChI=1S/C14H16N4O2S/c1-2-20-12-7-9(3-6-11(12)19)8-15-18-13(10-4-5-10)16-17-14(18)21/h3,6-8,10,15H,2,4-5H2,1H3,(H,17,21)