ethyl 2-azanyl-4-[(4-tert-butylphenyl)carbonyloxymethyl]-5-(methylcarbamoyl)thiophene-3-carboxylate

Systemtic Name: ethyl 2-azanyl-4-[(4-tert-butylphenyl)carbonyloxymethyl]-5-(methylcarbamoyl)thiophene-3-carboxylate Openeye Name: ethyl 2-amino-4-[(4-tert-butylbenzoyl)oxymethyl]-5-(methylcarbamoyl)thiophene-3-carboxylate CAS Name: 2-amino-4-[[(4-tert-butylphenyl)-oxomethoxy]methyl]-5-(methylcarbamoyl)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-amino-4-[(4-tert-butylbenzoyl)oxymethyl]-5-(methylcarbamoyl)thiophene-3-carboxylate Traditional Name: 2-amino-4-[(4-tert-butylbenzoyl)oxymethyl]-5-(methylcarbamoyl)thiophene-3-carboxylic acid ethyl ester Formula: C21H26N2O5S MolecularWeight: 418.50654

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1COC(=O)C2=CC=C(C=C2)C(C)(C)C)C(=O)NC)N

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1COC(=O)C2=CC=C(C=C2)C(C)(C)C)C(=O)NC)N

InChI

InChI=1S/C21H26N2O5S/c1-6-27-20(26)15-14(16(18(24)23-5)29-17(15)22)11-28-19(25)12-7-9-13(10-8-12)21(2,3)4/h7-10H,6,11,22H2,1-5H3,(H,23,24)