ethyl 2-[(3-methyl-6-oxidanylidene-1-phenyl-pyridazin-4-yl)amino]-4-(2-methylpropyl)thiophene-3-carboxylate

Systemtic Name: ethyl 2-[(3-methyl-6-oxidanylidene-1-phenyl-pyridazin-4-yl)amino]-4-(2-methylpropyl)thiophene-3-carboxylate Openeye Name: ethyl 4-isobutyl-2-[(3-methyl-6-oxo-1-phenyl-pyridazin-4-yl)amino]thiophene-3-carboxylate CAS Name: 2-[(3-methyl-6-oxo-1-phenyl-4-pyridazinyl)amino]-4-(2-methylpropyl)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(3-methyl-6-oxo-1-phenylpyridazin-4-yl)amino]-4-(2-methylpropyl)thiophene-3-carboxylate Traditional Name: 4-isobutyl-2-[(6-keto-3-methyl-1-phenyl-pyridazin-4-yl)amino]thiophene-3-carboxylic acid ethyl ester Formula: C22H25N3O3S MolecularWeight: 411.5172

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1CC(C)C)NC2=CC(=O)N(N=C2C)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(SC=C1CC(C)C)NC2=CC(=O)N(N=C2C)C3=CC=CC=C3

InChI

InChI=1S/C22H25N3O3S/c1-5-28-22(27)20-16(11-14(2)3)13-29-21(20)23-18-12-19(26)25(24-15(18)4)17-9-7-6-8-10-17/h6-10,12-14,23H,5,11H2,1-4H3