ethyl 3-[2-(2-methylbutan-2-ylamino)ethanoylamino]-5-phenyl-thiophene-2-carboxylate

Systemtic Name: ethyl 3-[2-(2-methylbutan-2-ylamino)ethanoylamino]-5-phenyl-thiophene-2-carboxylate Openeye Name: ethyl 3-[[2-(1,1-dimethylpropylamino)acetyl]amino]-5-phenyl-thiophene-2-carboxylate CAS Name: 3-[[2-(2-methylbutan-2-ylamino)-1-oxoethyl]amino]-5-phenyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[[2-(2-methylbutan-2-ylamino)acetyl]amino]-5-phenylthiophene-2-carboxylate Traditional Name: 3-[[2-(tert-amylamino)acetyl]amino]-5-phenyl-thiophene-2-carboxylic acid ethyl ester Formula: C20H26N2O3S MolecularWeight: 374.49704

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)NCC(=O)NC1=C(SC(=C1)C2=CC=CC=C2)C(=O)OCC

Isomeric SMILES

CCC(C)(C)NCC(=O)NC1=C(SC(=C1)C2=CC=CC=C2)C(=O)OCC

InChI

InChI=1S/C20H26N2O3S/c1-5-20(3,4)21-13-17(23)22-15-12-16(14-10-8-7-9-11-14)26-18(15)19(24)25-6-2/h7-12,21H,5-6,13H2,1-4H3,(H,22,23)