methyl 4-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethyl]-2-(2-phenylethanoylamino)thiophene-3-carboxylate

Systemtic Name: methyl 4-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethyl]-2-(2-phenylethanoylamino)thiophene-3-carboxylate Openeye Name: methyl 4-[2-(tert-butoxycarbonylamino)ethyl]-2-[(2-phenylacetyl)amino]thiophene-3-carboxylate CAS Name: 4-[2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]ethyl]-2-[(1-oxo-2-phenylethyl)amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethyl]-2-[(2-phenylacetyl)amino]thiophene-3-carboxylate Traditional Name: 4-[2-(tert-butoxycarbonylamino)ethyl]-2-[(2-phenylacetyl)amino]thiophene-3-carboxylic acid methyl ester Formula: C21H26N2O5S MolecularWeight: 418.50654

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCC1=CSC(=C1C(=O)OC)NC(=O)CC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)NCCC1=CSC(=C1C(=O)OC)NC(=O)CC2=CC=CC=C2

InChI

InChI=1S/C21H26N2O5S/c1-21(2,3)28-20(26)22-11-10-15-13-29-18(17(15)19(25)27-4)23-16(24)12-14-8-6-5-7-9-14/h5-9,13H,10-12H2,1-4H3,(H,22,26)(H,23,24)