ethyl 5-aminocarbonyl-4-methyl-2-[2-(3-methylpyrazol-1-yl)propanoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 5-aminocarbonyl-4-methyl-2-[2-(3-methylpyrazol-1-yl)propanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 5-carbamoyl-4-methyl-2-[2-(3-methylpyrazol-1-yl)propanoylamino]thiophene-3-carboxylate CAS Name: 5-carbamoyl-4-methyl-2-[[2-(3-methyl-1-pyrazolyl)-1-oxopropyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-carbamoyl-4-methyl-2-[2-(3-methylpyrazol-1-yl)propanoylamino]thiophene-3-carboxylate Traditional Name: 5-carbamoyl-4-methyl-2-[2-(3-methylpyrazol-1-yl)propanoylamino]thiophene-3-carboxylic acid ethyl ester Formula: C16H20N4O4S MolecularWeight: 364.4194

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)N)NC(=O)C(C)N2C=CC(=N2)C

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)N)NC(=O)C(C)N2C=CC(=N2)C

InChI

InChI=1S/C16H20N4O4S/c1-5-24-16(23)11-9(3)12(13(17)21)25-15(11)18-14(22)10(4)20-7-6-8(2)19-20/h6-7,10H,5H2,1-4H3,(H2,17,21)(H,18,22)