methyl 2-[5-chloranyl-6-oxidanylidene-4-(2-pyridin-3-ylethylamino)pyridazin-1-yl]benzoate

Systemtic Name: methyl 2-[5-chloranyl-6-oxidanylidene-4-(2-pyridin-3-ylethylamino)pyridazin-1-yl]benzoate Openeye Name: methyl 2-[5-chloro-6-oxo-4-[2-(3-pyridyl)ethylamino]pyridazin-1-yl]benzoate CAS Name: 2-[5-chloro-6-oxo-4-[2-(3-pyridinyl)ethylamino]-1-pyridazinyl]benzoic acid methyl ester IUPAC Name: methyl 2-[5-chloro-6-oxo-4-(2-pyridin-3-ylethylamino)pyridazin-1-yl]benzoate Traditional Name: 2-[5-chloro-6-keto-4-[2-(3-pyridyl)ethylamino]pyridazin-1-yl]benzoic acid methyl ester Formula: C19H17ClN4O3 MolecularWeight: 384.81628

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1N2C(=O)C(=C(C=N2)NCCC3=CN=CC=C3)Cl

Isomeric SMILES

COC(=O)C1=CC=CC=C1N2C(=O)C(=C(C=N2)NCCC3=CN=CC=C3)Cl

InChI

InChI=1S/C19H17ClN4O3/c1-27-19(26)14-6-2-3-7-16(14)24-18(25)17(20)15(12-23-24)22-10-8-13-5-4-9-21-11-13/h2-7,9,11-12,22H,8,10H2,1H3