ethyl 4-(3-nitrophenyl)-2-[[2-[(6-phenylpyridazin-3-yl)carbamoylamino]phenyl]amino]-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 4-(3-nitrophenyl)-2-[[2-[(6-phenylpyridazin-3-yl)carbamoylamino]phenyl]amino]-1H-pyrrole-3-carboxylate Openeye Name: ethyl 4-(3-nitrophenyl)-2-[2-[(6-phenylpyridazin-3-yl)carbamoylamino]anilino]-1H-pyrrole-3-carboxylate CAS Name: 4-(3-nitrophenyl)-2-[2-[[oxo-[(6-phenyl-3-pyridazinyl)amino]methyl]amino]anilino]-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 4-(3-nitrophenyl)-2-[2-[(6-phenylpyridazin-3-yl)carbamoylamino]anilino]-1H-pyrrole-3-carboxylate Traditional Name: 4-(3-nitrophenyl)-2-[2-[(6-phenylpyridazin-3-yl)carbamoylamino]anilino]-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C30H25N7O5 MolecularWeight: 563.5634

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC=C1C2=CC(=CC=C2)[N+](=O)[O-])NC3=CC=CC=C3NC(=O)NC4=NN=C(C=C4)C5=CC=CC=C5

Isomeric SMILES

CCOC(=O)C1=C(NC=C1C2=CC(=CC=C2)[N+](=O)[O-])NC3=CC=CC=C3NC(=O)NC4=NN=C(C=C4)C5=CC=CC=C5

InChI

InChI=1S/C30H25N7O5/c1-2-42-29(38)27-22(20-11-8-12-21(17-20)37(40)41)18-31-28(27)32-24-13-6-7-14-25(24)33-30(39)34-26-16-15-23(35-36-26)19-9-4-3-5-10-19/h3-18,31-32H,2H2,1H3,(H2,33,34,36,39)