ethyl 4-cyano-5-[2-[4-(1H-imidazol-2-yl)phenyl]carbonyloxyethanoylamino]-3-methyl-thiophene-2-carboxylate

Systemtic Name: ethyl 4-cyano-5-[2-[4-(1H-imidazol-2-yl)phenyl]carbonyloxyethanoylamino]-3-methyl-thiophene-2-carboxylate Openeye Name: ethyl 4-cyano-5-[[2-[4-(1H-imidazol-2-yl)benzoyl]oxyacetyl]amino]-3-methyl-thiophene-2-carboxylate CAS Name: 4-cyano-5-[[2-[[4-(1H-imidazol-2-yl)phenyl]-oxomethoxy]-1-oxoethyl]amino]-3-methyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-cyano-5-[[2-[4-(1H-imidazol-2-yl)benzoyl]oxyacetyl]amino]-3-methylthiophene-2-carboxylate Traditional Name: 4-cyano-5-[[2-[4-(1H-imidazol-2-yl)benzoyl]oxyacetyl]amino]-3-methyl-thiophene-2-carboxylic acid ethyl ester Formula: C21H18N4O5S MolecularWeight: 438.45642

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)NC(=O)COC(=O)C2=CC=C(C=C2)C3=NC=CN3)C#N)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)NC(=O)COC(=O)C2=CC=C(C=C2)C3=NC=CN3)C#N)C

InChI

InChI=1S/C21H18N4O5S/c1-3-29-21(28)17-12(2)15(10-22)19(31-17)25-16(26)11-30-20(27)14-6-4-13(5-7-14)18-23-8-9-24-18/h4-9H,3,11H2,1-2H3,(H,23,24)(H,25,26)