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

Systemtic Name: ethyl 4-cyano-5-[2-[4-(4,5-dimethyl-1H-imidazol-2-yl)phenyl]carbonyloxybutanoylamino]-3-methyl-thiophene-2-carboxylate Openeye Name: ethyl 4-cyano-5-[2-[4-(4,5-dimethyl-1H-imidazol-2-yl)benzoyl]oxybutanoylamino]-3-methyl-thiophene-2-carboxylate CAS Name: 4-cyano-5-[[2-[[4-(4,5-dimethyl-1H-imidazol-2-yl)phenyl]-oxomethoxy]-1-oxobutyl]amino]-3-methyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-cyano-5-[2-[4-(4,5-dimethyl-1H-imidazol-2-yl)benzoyl]oxybutanoylamino]-3-methylthiophene-2-carboxylate Traditional Name: 4-cyano-5-[2-[4-(4,5-dimethyl-1H-imidazol-2-yl)benzoyl]oxybutanoylamino]-3-methyl-thiophene-2-carboxylic acid ethyl ester Formula: C25H26N4O5S MolecularWeight: 494.56274

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=C(C(=C(S1)C(=O)OCC)C)C#N)OC(=O)C2=CC=C(C=C2)C3=NC(=C(N3)C)C

Isomeric SMILES

CCC(C(=O)NC1=C(C(=C(S1)C(=O)OCC)C)C#N)OC(=O)C2=CC=C(C=C2)C3=NC(=C(N3)C)C

InChI

InChI=1S/C25H26N4O5S/c1-6-19(22(30)29-23-18(12-26)13(3)20(35-23)25(32)33-7-2)34-24(31)17-10-8-16(9-11-17)21-27-14(4)15(5)28-21/h8-11,19H,6-7H2,1-5H3,(H,27,28)(H,29,30)