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

Systemtic Name: 4-[[(3-propan-2-yl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)amino]methylidene]cyclohexa-2,5-dien-1-one Openeye Name: 4-[[(3-isopropyl-5-thioxo-1H-1,2,4-triazol-4-yl)amino]methylene]cyclohexa-2,5-dien-1-one CAS Name: 4-[[(3-propan-2-yl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)amino]methylidene]-1-cyclohexa-2,5-dienone IUPAC Name: 4-[[(3-propan-2-yl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)amino]methylidene]cyclohexa-2,5-dien-1-one Traditional Name: 4-[[(3-isopropyl-5-thioxo-1H-1,2,4-triazol-4-yl)amino]methylene]cyclohexa-2,5-dien-1-one Formula: C12H14N4OS MolecularWeight: 262.33076

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NNC(=S)N1NC=C2C=CC(=O)C=C2

Isomeric SMILES

CC(C)C1=NNC(=S)N1NC=C2C=CC(=O)C=C2

InChI

InChI=1S/C12H14N4OS/c1-8(2)11-14-15-12(18)16(11)13-7-9-3-5-10(17)6-4-9/h3-8,13H,1-2H3,(H,15,18)