3-methyl-2-[[2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-(triphenylmethyl)sulfanyl-propyl]amino]pentanoic acid

Systemtic Name: 3-methyl-2-[[2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-(triphenylmethyl)sulfanyl-propyl]amino]pentanoic acid Openeye Name: 2-[[2-(tert-butoxycarbonylamino)-3-tritylsulfanyl-propyl]amino]-3-methyl-pentanoic acid CAS Name: 3-methyl-2-[[2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-[(triphenylmethyl)thio]propyl]amino]pentanoic acid IUPAC Name: 3-methyl-2-[[2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-tritylsulfanylpropyl]amino]pentanoic acid Traditional Name: 2-[[2-(tert-butoxycarbonylamino)-3-(tritylthio)propyl]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)NCC(CSC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)NC(=O)OC(C)(C)C

Isomeric SMILES

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

InChI

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