[2-[(6-phenylpyridazin-3-yl)carbamoylamino]phenyl] 2-azanyl-2-(4-bromophenyl)ethanoate

Systemtic Name: [2-[(6-phenylpyridazin-3-yl)carbamoylamino]phenyl] 2-azanyl-2-(4-bromophenyl)ethanoate Openeye Name: [2-[(6-phenylpyridazin-3-yl)carbamoylamino]phenyl] 2-amino-2-(4-bromophenyl)acetate CAS Name: 2-amino-2-(4-bromophenyl)acetic acid [2-[[oxo-[(6-phenyl-3-pyridazinyl)amino]methyl]amino]phenyl] ester IUPAC Name: [2-[(6-phenylpyridazin-3-yl)carbamoylamino]phenyl] 2-amino-2-(4-bromophenyl)acetate Traditional Name: 2-amino-2-(4-bromophenyl)acetic acid [2-[(6-phenylpyridazin-3-yl)carbamoylamino]phenyl] ester Formula: C25H20BrN5O3 MolecularWeight: 518.362

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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)C(C4=CC=C(C=C4)Br)N

Isomeric SMILES

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

InChI

InChI=1S/C25H20BrN5O3/c26-18-12-10-17(11-13-18)23(27)24(32)34-21-9-5-4-8-20(21)28-25(33)29-22-15-14-19(30-31-22)16-6-2-1-3-7-16/h1-15,23H,27H2,(H2,28,29,31,33)