(phenylmethyl) 2-[[3-cyclohexyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoyl]amino]-4-methylsulfanyl-butanoate

Systemtic Name: (phenylmethyl) 2-[[3-cyclohexyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoyl]amino]-4-methylsulfanyl-butanoate Openeye Name: benzyl 2-[[2-(tert-butoxycarbonylamino)-3-cyclohexyl-propanoyl]amino]-4-methylsulfanyl-butanoate CAS Name: 2-[[3-cyclohexyl-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxopropyl]amino]-4-(methylthio)butanoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[[3-cyclohexyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoyl]amino]-4-methylsulfanylbutanoate Traditional Name: 2-[[2-(tert-butoxycarbonylamino)-3-cyclohexyl-propanoyl]amino]-4-(methylthio)butyric acid benzyl ester Formula: C26H40N2O5S MolecularWeight: 492.6712

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1CCCCC1)C(=O)NC(CCSC)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)NC(CC1CCCCC1)C(=O)NC(CCSC)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C26H40N2O5S/c1-26(2,3)33-25(31)28-22(17-19-11-7-5-8-12-19)23(29)27-21(15-16-34-4)24(30)32-18-20-13-9-6-10-14-20/h6,9-10,13-14,19,21-22H,5,7-8,11-12,15-18H2,1-4H3,(H,27,29)(H,28,31)