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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)OC)NC(=O)CCNC(=O)C(C)(C)C

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)OC)NC(=O)CCNC(=O)C(C)(C)C

InChI

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