methyl 3-(3-imidazol-1-ylpropanoylamino)thiophene-2-carboxylate

Systemtic Name: methyl 3-(3-imidazol-1-ylpropanoylamino)thiophene-2-carboxylate Openeye Name: methyl 3-(3-imidazol-1-ylpropanoylamino)thiophene-2-carboxylate CAS Name: 3-[[3-(1-imidazolyl)-1-oxopropyl]amino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-(3-imidazol-1-ylpropanoylamino)thiophene-2-carboxylate Traditional Name: 3-(3-imidazol-1-ylpropanoylamino)thiophene-2-carboxylic acid methyl ester Formula: C12H13N3O3S MolecularWeight: 279.31492

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CS1)NC(=O)CCN2C=CN=C2

Isomeric SMILES

COC(=O)C1=C(C=CS1)NC(=O)CCN2C=CN=C2

InChI

InChI=1S/C12H13N3O3S/c1-18-12(17)11-9(3-7-19-11)14-10(16)2-5-15-6-4-13-8-15/h3-4,6-8H,2,5H2,1H3,(H,14,16)