(6Z)-6-(5-pyrimidin-2-yl-1,2-dihydro-1,2,4-triazol-3-ylidene)cyclohexa-2,4-dien-1-one

Systemtic Name: (6Z)-6-(5-pyrimidin-2-yl-1,2-dihydro-1,2,4-triazol-3-ylidene)cyclohexa-2,4-dien-1-one Openeye Name: (6Z)-6-(5-pyrimidin-2-yl-1,2-dihydro-1,2,4-triazol-3-ylidene)cyclohexa-2,4-dien-1-one CAS Name: (6Z)-6-[5-(2-pyrimidinyl)-1,2-dihydro-1,2,4-triazol-3-ylidene]-1-cyclohexa-2,4-dienone IUPAC Name: (6Z)-6-(5-pyrimidin-2-yl-1,2-dihydro-1,2,4-triazol-3-ylidene)cyclohexa-2,4-dien-1-one Traditional Name: (6Z)-6-[5-(2-pyrimidyl)-1,2-dihydro-1,2,4-triazol-3-ylidene]cyclohexa-2,4-dien-1-one Formula: C12H9N5O MolecularWeight: 239.23276

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C2NNC(=N2)C3=NC=CC=N3)C(=O)C=C1

Isomeric SMILES

C1=C/C(=C\2/NNC(=N2)C3=NC=CC=N3)/C(=O)C=C1

InChI

InChI=1S/C12H9N5O/c18-9-5-2-1-4-8(9)10-15-12(17-16-10)11-13-6-3-7-14-11/h1-7,16H,(H,15,17)/b10-8-