[2-[(6-phenylpyridazin-3-yl)carbamoylamino]phenyl] 2-azanyl-5-bromanyl-pyridine-3-carboxylate

Systemtic Name: [2-[(6-phenylpyridazin-3-yl)carbamoylamino]phenyl] 2-azanyl-5-bromanyl-pyridine-3-carboxylate Openeye Name: [2-[(6-phenylpyridazin-3-yl)carbamoylamino]phenyl] 2-amino-5-bromo-pyridine-3-carboxylate CAS Name: 2-amino-5-bromo-3-pyridinecarboxylic acid [2-[[oxo-[(6-phenyl-3-pyridazinyl)amino]methyl]amino]phenyl] ester IUPAC Name: [2-[(6-phenylpyridazin-3-yl)carbamoylamino]phenyl] 2-amino-5-bromopyridine-3-carboxylate Traditional Name: 2-amino-5-bromo-nicotinic acid [2-[(6-phenylpyridazin-3-yl)carbamoylamino]phenyl] ester Formula: C23H17BrN6O3 MolecularWeight: 505.32348

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN=C(C=C2)NC(=O)NC3=CC=CC=C3OC(=O)C4=CC(=CN=C4N)Br

Isomeric SMILES

C1=CC=C(C=C1)C2=NN=C(C=C2)NC(=O)NC3=CC=CC=C3OC(=O)C4=CC(=CN=C4N)Br

InChI

InChI=1S/C23H17BrN6O3/c24-15-12-16(21(25)26-13-15)22(31)33-19-9-5-4-8-18(19)27-23(32)28-20-11-10-17(29-30-20)14-6-2-1-3-7-14/h1-13H,(H2,25,26)(H2,27,28,30,32)