3-[azanyl-[2-[(2-methylpropan-2-yl)oxycarbonyl]-4-methylsulfanyl-butanoyl]amino]-2-cyclohexyl-propanoic acid

Systemtic Name: 3-[azanyl-[2-[(2-methylpropan-2-yl)oxycarbonyl]-4-methylsulfanyl-butanoyl]amino]-2-cyclohexyl-propanoic acid Openeye Name: 3-[amino-(2-tert-butoxycarbonyl-4-methylsulfanyl-butanoyl)amino]-2-cyclohexyl-propanoic acid CAS Name: 3-[amino-[2-[(2-methylpropan-2-yl)oxy-oxomethyl]-4-(methylthio)-1-oxobutyl]amino]-2-cyclohexylpropanoic acid IUPAC Name: 3-[amino-[2-[(2-methylpropan-2-yl)oxycarbonyl]-4-methylsulfanylbutanoyl]amino]-2-cyclohexylpropanoic acid Traditional Name: 3-[amino-[2-tert-butoxycarbonyl-4-(methylthio)butanoyl]amino]-2-cyclohexyl-propionic acid Formula: C19H34N2O5S MolecularWeight: 402.54866

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(CCSC)C(=O)N(CC(C1CCCCC1)C(=O)O)N

Isomeric SMILES

CC(C)(C)OC(=O)C(CCSC)C(=O)N(CC(C1CCCCC1)C(=O)O)N

InChI

InChI=1S/C19H34N2O5S/c1-19(2,3)26-18(25)14(10-11-27-4)16(22)21(20)12-15(17(23)24)13-8-6-5-7-9-13/h13-15H,5-12,20H2,1-4H3,(H,23,24)