ethyl 3-methyl-7-oxidanylidene-4-phenyl-6-propan-2-yl-thieno[2,3-d]pyridazine-2-carboxylate

Systemtic Name: ethyl 3-methyl-7-oxidanylidene-4-phenyl-6-propan-2-yl-thieno[2,3-d]pyridazine-2-carboxylate Openeye Name: ethyl 6-isopropyl-3-methyl-7-oxo-4-phenyl-thieno[2,3-d]pyridazine-2-carboxylate CAS Name: 3-methyl-7-oxo-4-phenyl-6-propan-2-yl-2-thieno[2,3-d]pyridazinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-methyl-7-oxo-4-phenyl-6-propan-2-ylthieno[2,3-d]pyridazine-2-carboxylate Traditional Name: 6-isopropyl-7-keto-3-methyl-4-phenyl-thieno[2,3-d]pyridazine-2-carboxylic acid ethyl ester Formula: C19H20N2O3S MolecularWeight: 356.4387

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(S1)C(=O)N(N=C2C3=CC=CC=C3)C(C)C)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(S1)C(=O)N(N=C2C3=CC=CC=C3)C(C)C)C

InChI

InChI=1S/C19H20N2O3S/c1-5-24-19(23)16-12(4)14-15(13-9-7-6-8-10-13)20-21(11(2)3)18(22)17(14)25-16/h6-11H,5H2,1-4H3