3-methyl-2-[[1-[(2-methylpropan-2-yl)oxycarbonylamino]-4,4,4-triphenyl-1-sulfanyl-butyl]amino]pentanoic acid

Systemtic Name: 3-methyl-2-[[1-[(2-methylpropan-2-yl)oxycarbonylamino]-4,4,4-triphenyl-1-sulfanyl-butyl]amino]pentanoic acid Openeye Name: 2-[[1-(tert-butoxycarbonylamino)-4,4,4-triphenyl-1-sulfanyl-butyl]amino]-3-methyl-pentanoic acid CAS Name: 2-[[1-mercapto-1-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-4,4,4-triphenylbutyl]amino]-3-methylpentanoic acid IUPAC Name: 3-methyl-2-[[1-[(2-methylpropan-2-yl)oxycarbonylamino]-4,4,4-triphenyl-1-sulfanylbutyl]amino]pentanoic acid Traditional Name: 2-[[1-(tert-butoxycarbonylamino)-1-mercapto-4,4,4-triphenyl-butyl]amino]-3-methyl-valeric acid Formula: C33H42N2O4S MolecularWeight: 562.76258

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)O)NC(CCC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)(NC(=O)OC(C)(C)C)S

Isomeric SMILES

CCC(C)C(C(=O)O)NC(CCC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)(NC(=O)OC(C)(C)C)S

InChI

InChI=1S/C33H42N2O4S/c1-6-24(2)28(29(36)37)34-33(40,35-30(38)39-31(3,4)5)23-22-32(25-16-10-7-11-17-25,26-18-12-8-13-19-26)27-20-14-9-15-21-27/h7-21,24,28,34,40H,6,22-23H2,1-5H3,(H,35,38)(H,36,37)