[2-[(2-chloranyl-4,6-dimethyl-phenyl)-ethanoyl-amino]-1,3-thiazol-4-yl]methyl 6-oxidanylidene-1-propyl-pyridazine-3-carboxylate

Systemtic Name: [2-[(2-chloranyl-4,6-dimethyl-phenyl)-ethanoyl-amino]-1,3-thiazol-4-yl]methyl 6-oxidanylidene-1-propyl-pyridazine-3-carboxylate Openeye Name: [2-(N-acetyl-2-chloro-4,6-dimethyl-anilino)thiazol-4-yl]methyl 6-oxo-1-propyl-pyridazine-3-carboxylate CAS Name: 6-oxo-1-propyl-3-pyridazinecarboxylic acid [2-(N-acetyl-2-chloro-4,6-dimethylanilino)-4-thiazolyl]methyl ester IUPAC Name: [2-(N-acetyl-2-chloro-4,6-dimethylanilino)-1,3-thiazol-4-yl]methyl 6-oxo-1-propylpyridazine-3-carboxylate Traditional Name: 6-keto-1-propyl-pyridazine-3-carboxylic acid [2-(N-acetyl-2-chloro-4,6-dimethyl-anilino)thiazol-4-yl]methyl ester Formula: C22H23ClN4O4S MolecularWeight: 474.96042

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C=CC(=N1)C(=O)OCC2=CSC(=N2)N(C3=C(C=C(C=C3Cl)C)C)C(=O)C

Isomeric SMILES

CCCN1C(=O)C=CC(=N1)C(=O)OCC2=CSC(=N2)N(C3=C(C=C(C=C3Cl)C)C)C(=O)C

InChI

InChI=1S/C22H23ClN4O4S/c1-5-8-26-19(29)7-6-18(25-26)21(30)31-11-16-12-32-22(24-16)27(15(4)28)20-14(3)9-13(2)10-17(20)23/h6-7,9-10,12H,5,8,11H2,1-4H3