methyl 4-methyl-5-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]-2-[2-(3-phenoxyphenyl)ethanoylamino]thiophene-3-carboxylate

Systemtic Name: methyl 4-methyl-5-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]-2-[2-(3-phenoxyphenyl)ethanoylamino]thiophene-3-carboxylate Openeye Name: methyl 5-[(tert-butoxycarbonylamino)methyl]-4-methyl-2-[[2-(3-phenoxyphenyl)acetyl]amino]thiophene-3-carboxylate CAS Name: 4-methyl-5-[[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]methyl]-2-[[1-oxo-2-(3-phenoxyphenyl)ethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-methyl-5-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]-2-[[2-(3-phenoxyphenyl)acetyl]amino]thiophene-3-carboxylate Traditional Name: 5-[(tert-butoxycarbonylamino)methyl]-4-methyl-2-[[2-(3-phenoxyphenyl)acetyl]amino]thiophene-3-carboxylic acid methyl ester Formula: C27H30N2O6S MolecularWeight: 510.6019

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=O)CC2=CC(=CC=C2)OC3=CC=CC=C3)CNC(=O)OC(C)(C)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=O)CC2=CC(=CC=C2)OC3=CC=CC=C3)CNC(=O)OC(C)(C)C

InChI

InChI=1S/C27H30N2O6S/c1-17-21(16-28-26(32)35-27(2,3)4)36-24(23(17)25(31)33-5)29-22(30)15-18-10-9-13-20(14-18)34-19-11-7-6-8-12-19/h6-14H,15-16H2,1-5H3,(H,28,32)(H,29,30)