methyl 2-(3,3-dimethylbutanoylamino)-3-[3-[(2-methylpropan-2-yl)oxycarbonylamino]propylsulfanyl]propanoate

Systemtic Name: methyl 2-(3,3-dimethylbutanoylamino)-3-[3-[(2-methylpropan-2-yl)oxycarbonylamino]propylsulfanyl]propanoate Openeye Name: methyl 3-[3-(tert-butoxycarbonylamino)propylsulfanyl]-2-(3,3-dimethylbutanoylamino)propanoate CAS Name: 2-[(3,3-dimethyl-1-oxobutyl)amino]-3-[3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propylthio]propanoic acid methyl ester IUPAC Name: methyl 2-(3,3-dimethylbutanoylamino)-3-[3-[(2-methylpropan-2-yl)oxycarbonylamino]propylsulfanyl]propanoate Traditional Name: 3-[3-(tert-butoxycarbonylamino)propylthio]-2-(3,3-dimethylbutanoylamino)propionic acid methyl ester Formula: C18H34N2O5S MolecularWeight: 390.53796

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(=O)NC(CSCCCNC(=O)OC(C)(C)C)C(=O)OC

Isomeric SMILES

CC(C)(C)CC(=O)NC(CSCCCNC(=O)OC(C)(C)C)C(=O)OC

InChI

InChI=1S/C18H34N2O5S/c1-17(2,3)11-14(21)20-13(15(22)24-7)12-26-10-8-9-19-16(23)25-18(4,5)6/h13H,8-12H2,1-7H3,(H,19,23)(H,20,21)