ethyl 3-[3-(2,2-dimethylpropanoylamino)propanoylamino]-5-(4-methoxyphenyl)thiophene-2-carboxylate

Systemtic Name: ethyl 3-[3-(2,2-dimethylpropanoylamino)propanoylamino]-5-(4-methoxyphenyl)thiophene-2-carboxylate Openeye Name: ethyl 3-[3-(2,2-dimethylpropanoylamino)propanoylamino]-5-(4-methoxyphenyl)thiophene-2-carboxylate CAS Name: 3-[[3-[(2,2-dimethyl-1-oxopropyl)amino]-1-oxopropyl]amino]-5-(4-methoxyphenyl)-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[3-(2,2-dimethylpropanoylamino)propanoylamino]-5-(4-methoxyphenyl)thiophene-2-carboxylate Traditional Name: 5-(4-methoxyphenyl)-3-[3-(pivaloylamino)propanoylamino]thiophene-2-carboxylic acid ethyl ester Formula: C22H28N2O5S MolecularWeight: 432.53312

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(S1)C2=CC=C(C=C2)OC)NC(=O)CCNC(=O)C(C)(C)C

Isomeric SMILES

CCOC(=O)C1=C(C=C(S1)C2=CC=C(C=C2)OC)NC(=O)CCNC(=O)C(C)(C)C

InChI

InChI=1S/C22H28N2O5S/c1-6-29-20(26)19-16(24-18(25)11-12-23-21(27)22(2,3)4)13-17(30-19)14-7-9-15(28-5)10-8-14/h7-10,13H,6,11-12H2,1-5H3,(H,23,27)(H,24,25)