ethyl 5-[2-(4-aminophenyl)carbonyloxypropanoylamino]-4-cyano-3-methyl-thiophene-2-carboxylate

Systemtic Name: ethyl 5-[2-(4-aminophenyl)carbonyloxypropanoylamino]-4-cyano-3-methyl-thiophene-2-carboxylate Openeye Name: ethyl 5-[2-(4-aminobenzoyl)oxypropanoylamino]-4-cyano-3-methyl-thiophene-2-carboxylate CAS Name: 5-[[2-[(4-aminophenyl)-oxomethoxy]-1-oxopropyl]amino]-4-cyano-3-methyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[2-(4-aminobenzoyl)oxypropanoylamino]-4-cyano-3-methylthiophene-2-carboxylate Traditional Name: 5-[2-(4-aminobenzoyl)oxypropanoylamino]-4-cyano-3-methyl-thiophene-2-carboxylic acid ethyl ester Formula: C19H19N3O5S MolecularWeight: 401.43626

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)NC(=O)C(C)OC(=O)C2=CC=C(C=C2)N)C#N)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)NC(=O)C(C)OC(=O)C2=CC=C(C=C2)N)C#N)C

InChI

InChI=1S/C19H19N3O5S/c1-4-26-19(25)15-10(2)14(9-20)17(28-15)22-16(23)11(3)27-18(24)12-5-7-13(21)8-6-12/h5-8,11H,4,21H2,1-3H3,(H,22,23)