(6E)-2-bromanyl-4-chloranyl-6-(5-pyridin-2-yl-1,2-dihydro-1,2,4-triazol-3-ylidene)cyclohexa-2,4-dien-1-one

Systemtic Name: (6E)-2-bromanyl-4-chloranyl-6-(5-pyridin-2-yl-1,2-dihydro-1,2,4-triazol-3-ylidene)cyclohexa-2,4-dien-1-one Openeye Name: (6E)-2-bromo-4-chloro-6-[5-(2-pyridyl)-1,2-dihydro-1,2,4-triazol-3-ylidene]cyclohexa-2,4-dien-1-one CAS Name: (6E)-2-bromo-4-chloro-6-[5-(2-pyridinyl)-1,2-dihydro-1,2,4-triazol-3-ylidene]-1-cyclohexa-2,4-dienone IUPAC Name: (6E)-2-bromo-4-chloro-6-(5-pyridin-2-yl-1,2-dihydro-1,2,4-triazol-3-ylidene)cyclohexa-2,4-dien-1-one Traditional Name: (6E)-2-bromo-4-chloro-6-[5-(2-pyridyl)-1,2-dihydro-1,2,4-triazol-3-ylidene]cyclohexa-2,4-dien-1-one Formula: C13H8BrClN4O MolecularWeight: 351.58582

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)C2=NC(=C3C=C(C=C(C3=O)Br)Cl)NN2

Isomeric SMILES

C1=CC=NC(=C1)C2=N/C(=C\3/C=C(C=C(C3=O)Br)Cl)/NN2

InChI

InChI=1S/C13H8BrClN4O/c14-9-6-7(15)5-8(11(9)20)12-17-13(19-18-12)10-3-1-2-4-16-10/h1-6,18H,(H,17,19)/b12-8+