[1-oxidanylidene-1-(thiophen-2-ylmethylamino)propan-2-yl] 4-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]benzoate

Systemtic Name: [1-oxidanylidene-1-(thiophen-2-ylmethylamino)propan-2-yl] 4-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]benzoate Openeye Name: [1-methyl-2-oxo-2-(2-thienylmethylamino)ethyl] 4-[(tert-butoxycarbonylamino)methyl]benzoate CAS Name: 4-[[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]methyl]benzoic acid [1-oxo-1-(thiophen-2-ylmethylamino)propan-2-yl] ester IUPAC Name: [1-oxo-1-(thiophen-2-ylmethylamino)propan-2-yl] 4-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]benzoate Traditional Name: 4-[(tert-butoxycarbonylamino)methyl]benzoic acid [2-keto-1-methyl-2-(2-thenylamino)ethyl] ester Formula: C21H26N2O5S MolecularWeight: 418.50654

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=CS1)OC(=O)C2=CC=C(C=C2)CNC(=O)OC(C)(C)C

Isomeric SMILES

CC(C(=O)NCC1=CC=CS1)OC(=O)C2=CC=C(C=C2)CNC(=O)OC(C)(C)C

InChI

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