ethyl 2-azanyl-5-(methylcarbamoyl)-4-[3-(3-methylphenoxy)propanoyloxymethyl]thiophene-3-carboxylate

Systemtic Name: ethyl 2-azanyl-5-(methylcarbamoyl)-4-[3-(3-methylphenoxy)propanoyloxymethyl]thiophene-3-carboxylate Openeye Name: ethyl 2-amino-5-(methylcarbamoyl)-4-[3-(3-methylphenoxy)propanoyloxymethyl]thiophene-3-carboxylate CAS Name: 2-amino-5-(methylcarbamoyl)-4-[[3-(3-methylphenoxy)-1-oxopropoxy]methyl]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-amino-5-(methylcarbamoyl)-4-[3-(3-methylphenoxy)propanoyloxymethyl]thiophene-3-carboxylate Traditional Name: 2-amino-5-(methylcarbamoyl)-4-[3-(3-methylphenoxy)propanoyloxymethyl]thiophene-3-carboxylic acid ethyl ester Formula: C20H24N2O6S MolecularWeight: 420.47936

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1COC(=O)CCOC2=CC=CC(=C2)C)C(=O)NC)N

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1COC(=O)CCOC2=CC=CC(=C2)C)C(=O)NC)N

InChI

InChI=1S/C20H24N2O6S/c1-4-26-20(25)16-14(17(19(24)22-3)29-18(16)21)11-28-15(23)8-9-27-13-7-5-6-12(2)10-13/h5-7,10H,4,8-9,11,21H2,1-3H3,(H,22,24)