methyl 4-cyano-3-methyl-5-[[4-(2-methylpropoxy)phenyl]carbonylamino]thiophene-2-carboxylate

Systemtic Name: methyl 4-cyano-3-methyl-5-[[4-(2-methylpropoxy)phenyl]carbonylamino]thiophene-2-carboxylate Openeye Name: methyl 4-cyano-5-[(4-isobutoxybenzoyl)amino]-3-methyl-thiophene-2-carboxylate CAS Name: 4-cyano-3-methyl-5-[[[4-(2-methylpropoxy)phenyl]-oxomethyl]amino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-cyano-3-methyl-5-[[4-(2-methylpropoxy)benzoyl]amino]thiophene-2-carboxylate Traditional Name: 4-cyano-5-[(4-isobutoxybenzoyl)amino]-3-methyl-thiophene-2-carboxylic acid methyl ester Formula: C19H20N2O4S MolecularWeight: 372.4381

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C#N)NC(=O)C2=CC=C(C=C2)OCC(C)C)C(=O)OC

Isomeric SMILES

CC1=C(SC(=C1C#N)NC(=O)C2=CC=C(C=C2)OCC(C)C)C(=O)OC

InChI

InChI=1S/C19H20N2O4S/c1-11(2)10-25-14-7-5-13(6-8-14)17(22)21-18-15(9-20)12(3)16(26-18)19(23)24-4/h5-8,11H,10H2,1-4H3,(H,21,22)