ethyl 6-azanylidene-5-cyano-1-(3-cyano-5,5-dimethyl-7-oxidanylidene-4,6-dihydro-1-benzothiophen-2-yl)-4-methyl-pyridazine-3-carboxylate

Systemtic Name: ethyl 6-azanylidene-5-cyano-1-(3-cyano-5,5-dimethyl-7-oxidanylidene-4,6-dihydro-1-benzothiophen-2-yl)-4-methyl-pyridazine-3-carboxylate Openeye Name: ethyl 5-cyano-1-(3-cyano-5,5-dimethyl-7-oxo-4,6-dihydrobenzothiophen-2-yl)-6-imino-4-methyl-pyridazine-3-carboxylate CAS Name: 5-cyano-1-(3-cyano-5,5-dimethyl-7-oxo-4,6-dihydro-1-benzothiophen-2-yl)-6-imino-4-methyl-3-pyridazinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-cyano-1-(3-cyano-5,5-dimethyl-7-oxo-4,6-dihydro-1-benzothiophen-2-yl)-6-imino-4-methylpyridazine-3-carboxylate Traditional Name: 5-cyano-1-(3-cyano-7-keto-5,5-dimethyl-4,6-dihydrobenzothiophen-2-yl)-6-imino-4-methyl-pyridazine-3-carboxylic acid ethyl ester Formula: C20H19N5O3S MolecularWeight: 409.46156

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=N)C(=C1C)C#N)C2=C(C3=C(S2)C(=O)CC(C3)(C)C)C#N

Isomeric SMILES

CCOC(=O)C1=NN(C(=N)C(=C1C)C#N)C2=C(C3=C(S2)C(=O)CC(C3)(C)C)C#N

InChI

InChI=1S/C20H19N5O3S/c1-5-28-19(27)15-10(2)12(8-21)17(23)25(24-15)18-13(9-22)11-6-20(3,4)7-14(26)16(11)29-18/h23H,5-7H2,1-4H3