(6Z)-4-bromanyl-6-[2-methyl-5-(3-methylpyridin-2-yl)-1H-1,2,4-triazol-3-ylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: (6Z)-4-bromanyl-6-[2-methyl-5-(3-methylpyridin-2-yl)-1H-1,2,4-triazol-3-ylidene]cyclohexa-2,4-dien-1-one Openeye Name: (6Z)-4-bromo-6-[2-methyl-5-(3-methyl-2-pyridyl)-1H-1,2,4-triazol-3-ylidene]cyclohexa-2,4-dien-1-one CAS Name: (6Z)-4-bromo-6-[2-methyl-5-(3-methyl-2-pyridinyl)-1H-1,2,4-triazol-3-ylidene]-1-cyclohexa-2,4-dienone IUPAC Name: (6Z)-4-bromo-6-[2-methyl-5-(3-methylpyridin-2-yl)-1H-1,2,4-triazol-3-ylidene]cyclohexa-2,4-dien-1-one Traditional Name: (6Z)-4-bromo-6-[2-methyl-5-(3-methyl-2-pyridyl)-1H-1,2,4-triazol-3-ylidene]cyclohexa-2,4-dien-1-one Formula: C15H13BrN4O MolecularWeight: 345.19392

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CC=C1)C2=NC(=C3C=C(C=CC3=O)Br)N(N2)C

Isomeric SMILES

CC1=C(N=CC=C1)C2=N/C(=C/3\C=C(C=CC3=O)Br)/N(N2)C

InChI

InChI=1S/C15H13BrN4O/c1-9-4-3-7-17-13(9)14-18-15(20(2)19-14)11-8-10(16)5-6-12(11)21/h3-8H,1-2H3,(H,18,19)/b15-11-