ethyl 4-cyano-5-[(3,4-diethoxyphenyl)carbonylamino]-3-methyl-thiophene-2-carboxylate

Systemtic Name: ethyl 4-cyano-5-[(3,4-diethoxyphenyl)carbonylamino]-3-methyl-thiophene-2-carboxylate Openeye Name: ethyl 4-cyano-5-[(3,4-diethoxybenzoyl)amino]-3-methyl-thiophene-2-carboxylate CAS Name: 4-cyano-5-[[(3,4-diethoxyphenyl)-oxomethyl]amino]-3-methyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-cyano-5-[(3,4-diethoxybenzoyl)amino]-3-methylthiophene-2-carboxylate Traditional Name: 4-cyano-5-[(3,4-diethoxybenzoyl)amino]-3-methyl-thiophene-2-carboxylic acid ethyl ester Formula: C20H22N2O5S MolecularWeight: 402.46408

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)NC2=C(C(=C(S2)C(=O)OCC)C)C#N)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)NC2=C(C(=C(S2)C(=O)OCC)C)C#N)OCC

InChI

InChI=1S/C20H22N2O5S/c1-5-25-15-9-8-13(10-16(15)26-6-2)18(23)22-19-14(11-21)12(4)17(28-19)20(24)27-7-3/h8-10H,5-7H2,1-4H3,(H,22,23)