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

Systemtic Name: (6Z)-4-bromanyl-6-(5-pyrimidin-2-yl-1,2-dihydro-1,2,4-triazol-3-ylidene)cyclohexa-2,4-dien-1-one Openeye Name: (6Z)-4-bromo-6-(5-pyrimidin-2-yl-1,2-dihydro-1,2,4-triazol-3-ylidene)cyclohexa-2,4-dien-1-one CAS Name: (6Z)-4-bromo-6-[5-(2-pyrimidinyl)-1,2-dihydro-1,2,4-triazol-3-ylidene]-1-cyclohexa-2,4-dienone IUPAC Name: (6Z)-4-bromo-6-(5-pyrimidin-2-yl-1,2-dihydro-1,2,4-triazol-3-ylidene)cyclohexa-2,4-dien-1-one Traditional Name: (6Z)-4-bromo-6-[5-(2-pyrimidyl)-1,2-dihydro-1,2,4-triazol-3-ylidene]cyclohexa-2,4-dien-1-one Formula: C12H8BrN5O MolecularWeight: 318.12882

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(N=C1)C2=NC(=C3C=C(C=CC3=O)Br)NN2

Isomeric SMILES

C1=CN=C(N=C1)C2=N/C(=C/3\C=C(C=CC3=O)Br)/NN2

InChI

InChI=1S/C12H8BrN5O/c13-7-2-3-9(19)8(6-7)10-16-12(18-17-10)11-14-4-1-5-15-11/h1-6,17H,(H,16,18)/b10-8-