methyl 2-[[4-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]carbonylamino]-4-methylsulfanyl-butanoate

Systemtic Name: methyl 2-[[4-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]carbonylamino]-4-methylsulfanyl-butanoate Openeye Name: methyl 2-[[4-(tert-butoxycarbonylamino)benzoyl]amino]-4-methylsulfanyl-butanoate CAS Name: 2-[[[4-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]phenyl]-oxomethyl]amino]-4-(methylthio)butanoic acid methyl ester IUPAC Name: methyl 2-[[4-[(2-methylpropan-2-yl)oxycarbonylamino]benzoyl]amino]-4-methylsulfanylbutanoate Traditional Name: 2-[[4-(tert-butoxycarbonylamino)benzoyl]amino]-4-(methylthio)butyric acid methyl ester Formula: C18H26N2O5S MolecularWeight: 382.47444

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1=CC=C(C=C1)C(=O)NC(CCSC)C(=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)NC1=CC=C(C=C1)C(=O)NC(CCSC)C(=O)OC

InChI

InChI=1S/C18H26N2O5S/c1-18(2,3)25-17(23)19-13-8-6-12(7-9-13)15(21)20-14(10-11-26-5)16(22)24-4/h6-9,14H,10-11H2,1-5H3,(H,19,23)(H,20,21)