ethyl 4-cyano-5-[4-(4-methoxyphenoxy)butanoylamino]-3-methyl-thiophene-2-carboxylate

Systemtic Name: ethyl 4-cyano-5-[4-(4-methoxyphenoxy)butanoylamino]-3-methyl-thiophene-2-carboxylate Openeye Name: ethyl 4-cyano-5-[4-(4-methoxyphenoxy)butanoylamino]-3-methyl-thiophene-2-carboxylate CAS Name: 4-cyano-5-[[4-(4-methoxyphenoxy)-1-oxobutyl]amino]-3-methyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-cyano-5-[4-(4-methoxyphenoxy)butanoylamino]-3-methylthiophene-2-carboxylate Traditional Name: 4-cyano-5-[4-(4-methoxyphenoxy)butanoylamino]-3-methyl-thiophene-2-carboxylic acid ethyl ester Formula: C20H22N2O5S MolecularWeight: 402.46408

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)NC(=O)CCCOC2=CC=C(C=C2)OC)C#N)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)NC(=O)CCCOC2=CC=C(C=C2)OC)C#N)C

InChI

InChI=1S/C20H22N2O5S/c1-4-26-20(24)18-13(2)16(12-21)19(28-18)22-17(23)6-5-11-27-15-9-7-14(25-3)8-10-15/h7-10H,4-6,11H2,1-3H3,(H,22,23)