ethyl 4-(3,4-dimethoxyphenyl)-2-[2-(2-methylbutan-2-ylamino)ethanoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 4-(3,4-dimethoxyphenyl)-2-[2-(2-methylbutan-2-ylamino)ethanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 4-(3,4-dimethoxyphenyl)-2-[[2-(1,1-dimethylpropylamino)acetyl]amino]thiophene-3-carboxylate CAS Name: 4-(3,4-dimethoxyphenyl)-2-[[2-(2-methylbutan-2-ylamino)-1-oxoethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(3,4-dimethoxyphenyl)-2-[[2-(2-methylbutan-2-ylamino)acetyl]amino]thiophene-3-carboxylate Traditional Name: 2-[[2-(tert-amylamino)acetyl]amino]-4-(3,4-dimethoxyphenyl)thiophene-3-carboxylic acid ethyl ester Formula: C22H30N2O5S MolecularWeight: 434.549

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)NCC(=O)NC1=C(C(=CS1)C2=CC(=C(C=C2)OC)OC)C(=O)OCC

Isomeric SMILES

CCC(C)(C)NCC(=O)NC1=C(C(=CS1)C2=CC(=C(C=C2)OC)OC)C(=O)OCC

InChI

InChI=1S/C22H30N2O5S/c1-7-22(3,4)23-12-18(25)24-20-19(21(26)29-8-2)15(13-30-20)14-9-10-16(27-5)17(11-14)28-6/h9-11,13,23H,7-8,12H2,1-6H3,(H,24,25)