ethyl 5,6-diphenyl-3-[(4-pyrrolidin-1-ylphenyl)amino]pyridazine-4-carboxylate

Systemtic Name: ethyl 5,6-diphenyl-3-[(4-pyrrolidin-1-ylphenyl)amino]pyridazine-4-carboxylate Openeye Name: ethyl 5,6-diphenyl-3-(4-pyrrolidin-1-ylanilino)pyridazine-4-carboxylate CAS Name: 5,6-diphenyl-3-[4-(1-pyrrolidinyl)anilino]-4-pyridazinecarboxylic acid ethyl ester IUPAC Name: ethyl 5,6-diphenyl-3-(4-pyrrolidin-1-ylanilino)pyridazine-4-carboxylate Traditional Name: 5,6-diphenyl-3-(4-pyrrolidinoanilino)pyridazine-4-carboxylic acid ethyl ester Formula: C29H28N4O2 MolecularWeight: 464.55822

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=NN=C1NC2=CC=C(C=C2)N3CCCC3)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CCOC(=O)C1=C(C(=NN=C1NC2=CC=C(C=C2)N3CCCC3)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C29H28N4O2/c1-2-35-29(34)26-25(21-11-5-3-6-12-21)27(22-13-7-4-8-14-22)31-32-28(26)30-23-15-17-24(18-16-23)33-19-9-10-20-33/h3-8,11-18H,2,9-10,19-20H2,1H3,(H,30,32)