ethyl 1-(4-methylphenyl)-6-oxidanylidene-4-[(phenylmethyl)amino]pyridazine-3-carboxylate

Systemtic Name: ethyl 1-(4-methylphenyl)-6-oxidanylidene-4-[(phenylmethyl)amino]pyridazine-3-carboxylate Openeye Name: ethyl 4-(benzylamino)-6-oxo-1-(p-tolyl)pyridazine-3-carboxylate CAS Name: 1-(4-methylphenyl)-6-oxo-4-[(phenylmethyl)amino]-3-pyridazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(benzylamino)-1-(4-methylphenyl)-6-oxopyridazine-3-carboxylate Traditional Name: 4-(benzylamino)-6-keto-1-(p-tolyl)pyridazine-3-carboxylic acid ethyl ester Formula: C21H21N3O3 MolecularWeight: 363.40974

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=O)C=C1NCC2=CC=CC=C2)C3=CC=C(C=C3)C

Isomeric SMILES

CCOC(=O)C1=NN(C(=O)C=C1NCC2=CC=CC=C2)C3=CC=C(C=C3)C

InChI

InChI=1S/C21H21N3O3/c1-3-27-21(26)20-18(22-14-16-7-5-4-6-8-16)13-19(25)24(23-20)17-11-9-15(2)10-12-17/h4-13,22H,3,14H2,1-2H3