propan-2-yl 4-cyano-3-methyl-5-[(3,4,5-triethoxyphenyl)carbonylamino]thiophene-2-carboxylate

Systemtic Name: propan-2-yl 4-cyano-3-methyl-5-[(3,4,5-triethoxyphenyl)carbonylamino]thiophene-2-carboxylate Openeye Name: isopropyl 4-cyano-3-methyl-5-[(3,4,5-triethoxybenzoyl)amino]thiophene-2-carboxylate CAS Name: 4-cyano-3-methyl-5-[[oxo-(3,4,5-triethoxyphenyl)methyl]amino]-2-thiophenecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-cyano-3-methyl-5-[(3,4,5-triethoxybenzoyl)amino]thiophene-2-carboxylate Traditional Name: 4-cyano-3-methyl-5-[(3,4,5-triethoxybenzoyl)amino]thiophene-2-carboxylic acid isopropyl ester Formula: C23H28N2O6S MolecularWeight: 460.54322

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NC2=C(C(=C(S2)C(=O)OC(C)C)C)C#N

Isomeric SMILES

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NC2=C(C(=C(S2)C(=O)OC(C)C)C)C#N

InChI

InChI=1S/C23H28N2O6S/c1-7-28-17-10-15(11-18(29-8-2)19(17)30-9-3)21(26)25-22-16(12-24)14(6)20(32-22)23(27)31-13(4)5/h10-11,13H,7-9H2,1-6H3,(H,25,26)