N-[3-[(E)-N-[(4-bromanyl-1-methyl-pyrazol-3-yl)carbonylamino]-C-methyl-carbonimidoyl]phenyl]pyridine-4-carboxamide

Systemtic Name: N-[3-[(E)-N-[(4-bromanyl-1-methyl-pyrazol-3-yl)carbonylamino]-C-methyl-carbonimidoyl]phenyl]pyridine-4-carboxamide Openeye Name: N-[3-[(E)-N-[(4-bromo-1-methyl-pyrazole-3-carbonyl)amino]-C-methyl-carbonimidoyl]phenyl]pyridine-4-carboxamide CAS Name: N-[3-[(1E)-1-[[(4-bromo-1-methyl-3-pyrazolyl)-oxomethyl]hydrazinylidene]ethyl]phenyl]-4-pyridinecarboxamide IUPAC Name: N-[3-[(E)-N-[(4-bromo-1-methylpyrazole-3-carbonyl)amino]-C-methylcarbonimidoyl]phenyl]pyridine-4-carboxamide Traditional Name: N-[3-[(E)-N-[(4-bromo-1-methyl-pyrazole-3-carbonyl)amino]-C-methyl-carbonimidoyl]phenyl]isonicotinamide Formula: C19H17BrN6O2 MolecularWeight: 441.28128

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C1=NN(C=C1Br)C)C2=CC(=CC=C2)NC(=O)C3=CC=NC=C3

Isomeric SMILES

C/C(=N\NC(=O)C1=NN(C=C1Br)C)/C2=CC(=CC=C2)NC(=O)C3=CC=NC=C3

InChI

InChI=1S/C19H17BrN6O2/c1-12(23-24-19(28)17-16(20)11-26(2)25-17)14-4-3-5-15(10-14)22-18(27)13-6-8-21-9-7-13/h3-11H,1-2H3,(H,22,27)(H,24,28)/b23-12+