ethyl 2-[(2,2-dicyano-1-methylsulfanyl-ethenyl)amino]-5-methyl-4-phenyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[(2,2-dicyano-1-methylsulfanyl-ethenyl)amino]-5-methyl-4-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[(2,2-dicyano-1-methylsulfanyl-vinyl)amino]-5-methyl-4-phenyl-thiophene-3-carboxylate CAS Name: 2-[[2,2-dicyano-1-(methylthio)ethenyl]amino]-5-methyl-4-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(2,2-dicyano-1-methylsulfanylethenyl)amino]-5-methyl-4-phenylthiophene-3-carboxylate Traditional Name: 2-[[2,2-dicyano-1-(methylthio)vinyl]amino]-5-methyl-4-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C19H17N3O2S2 MolecularWeight: 383.48718

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C2=CC=CC=C2)C)NC(=C(C#N)C#N)SC

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C2=CC=CC=C2)C)NC(=C(C#N)C#N)SC

InChI

InChI=1S/C19H17N3O2S2/c1-4-24-19(23)16-15(13-8-6-5-7-9-13)12(2)26-18(16)22-17(25-3)14(10-20)11-21/h5-9,22H,4H2,1-3H3