2-[4-cyclohexyl-3-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxidanyl-butyl]sulfanyl-4-methyl-pentanoate

Systemtic Name: 2-[4-cyclohexyl-3-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxidanyl-butyl]sulfanyl-4-methyl-pentanoate Openeye Name: 2-[3-(tert-butoxycarbonylamino)-4-cyclohexyl-2-hydroxy-butyl]sulfanyl-4-methyl-pentanoate CAS Name: 2-[[4-cyclohexyl-2-hydroxy-3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]butyl]thio]-4-methylpentanoate IUPAC Name: 2-[4-cyclohexyl-2-hydroxy-3-[(2-methylpropan-2-yl)oxycarbonylamino]butyl]sulfanyl-4-methylpentanoate Traditional Name: 2-[[3-(tert-butoxycarbonylamino)-4-cyclohexyl-2-hydroxy-butyl]thio]-4-methyl-valerate Formula: C21H38NO5S- MolecularWeight: 416.59512

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)[O-])SCC(C(CC1CCCCC1)NC(=O)OC(C)(C)C)O

Isomeric SMILES

CC(C)CC(C(=O)[O-])SCC(C(CC1CCCCC1)NC(=O)OC(C)(C)C)O

InChI

InChI=1S/C21H39NO5S/c1-14(2)11-18(19(24)25)28-13-17(23)16(12-15-9-7-6-8-10-15)22-20(26)27-21(3,4)5/h14-18,23H,6-13H2,1-5H3,(H,22,26)(H,24,25)/p-1