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

Systemtic Name: 4-[[(3-cyclopropyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)amino]methylidene]-3-oxidanyl-cyclohexa-2,5-dien-1-one Openeye Name: 4-[[(3-cyclopropyl-5-thioxo-1H-1,2,4-triazol-4-yl)amino]methylene]-3-hydroxy-cyclohexa-2,5-dien-1-one CAS Name: 4-[[(3-cyclopropyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)amino]methylidene]-3-hydroxy-1-cyclohexa-2,5-dienone IUPAC Name: 4-[[(3-cyclopropyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)amino]methylidene]-3-hydroxycyclohexa-2,5-dien-1-one Traditional Name: 4-[[(3-cyclopropyl-5-thioxo-1H-1,2,4-triazol-4-yl)amino]methylene]-3-hydroxy-cyclohexa-2,5-dien-1-one Formula: C12H12N4O2S MolecularWeight: 276.31428

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NNC(=S)N2NC=C3C=CC(=O)C=C3O

Isomeric SMILES

C1CC1C2=NNC(=S)N2NC=C3C=CC(=O)C=C3O

InChI

InChI=1S/C12H12N4O2S/c17-9-4-3-8(10(18)5-9)6-13-16-11(7-1-2-7)14-15-12(16)19/h3-7,13,18H,1-2H2,(H,15,19)