ethyl 4-[2-[3-[(4-methylphenyl)carbamoyl]-6-oxidanylidene-pyridazin-1-yl]ethanoyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-[3-[(4-methylphenyl)carbamoyl]-6-oxidanylidene-pyridazin-1-yl]ethanoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[2-[6-oxo-3-(p-tolylcarbamoyl)pyridazin-1-yl]acetyl]piperazine-1-carboxylate CAS Name: 4-[2-[3-[(4-methylanilino)-oxomethyl]-6-oxo-1-pyridazinyl]-1-oxoethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-[3-[(4-methylphenyl)carbamoyl]-6-oxopyridazin-1-yl]acetyl]piperazine-1-carboxylate Traditional Name: 4-[2-[6-keto-3-(p-tolylcarbamoyl)pyridazin-1-yl]acetyl]piperazine-1-carboxylic acid ethyl ester Formula: C21H25N5O5 MolecularWeight: 427.4537

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)CN2C(=O)C=CC(=N2)C(=O)NC3=CC=C(C=C3)C

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)CN2C(=O)C=CC(=N2)C(=O)NC3=CC=C(C=C3)C

InChI

InChI=1S/C21H25N5O5/c1-3-31-21(30)25-12-10-24(11-13-25)19(28)14-26-18(27)9-8-17(23-26)20(29)22-16-6-4-15(2)5-7-16/h4-9H,3,10-14H2,1-2H3,(H,22,29)