2-acetyloxyethyl 1-ethyl-5-[(4-methylpyridin-3-yl)amino]-6-oxidanylidene-3-thiophen-2-yl-pyridazine-4-carboxylate

Systemtic Name: 2-acetyloxyethyl 1-ethyl-5-[(4-methylpyridin-3-yl)amino]-6-oxidanylidene-3-thiophen-2-yl-pyridazine-4-carboxylate Openeye Name: 2-acetoxyethyl 1-ethyl-5-[(4-methyl-3-pyridyl)amino]-6-oxo-3-(2-thienyl)pyridazine-4-carboxylate CAS Name: 1-ethyl-5-[(4-methyl-3-pyridinyl)amino]-6-oxo-3-thiophen-2-yl-4-pyridazinecarboxylic acid 2-acetyloxyethyl ester IUPAC Name: 2-acetyloxyethyl 1-ethyl-5-[(4-methylpyridin-3-yl)amino]-6-oxo-3-thiophen-2-ylpyridazine-4-carboxylate Traditional Name: 1-ethyl-6-keto-5-[(4-methyl-3-pyridyl)amino]-3-(2-thienyl)pyridazine-4-carboxylic acid 2-acetoxyethyl ester Formula: C21H22N4O5S MolecularWeight: 442.48818

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C(=C(C(=N1)C2=CC=CS2)C(=O)OCCOC(=O)C)NC3=C(C=CN=C3)C

Isomeric SMILES

CCN1C(=O)C(=C(C(=N1)C2=CC=CS2)C(=O)OCCOC(=O)C)NC3=C(C=CN=C3)C

InChI

InChI=1S/C21H22N4O5S/c1-4-25-20(27)19(23-15-12-22-8-7-13(15)2)17(18(24-25)16-6-5-11-31-16)21(28)30-10-9-29-14(3)26/h5-8,11-12,23H,4,9-10H2,1-3H3