2-azanyl-2-ethyl-3-(triphenylmethyl)sulfanyl-butanoic acid

Systemtic Name: 2-azanyl-2-ethyl-3-(triphenylmethyl)sulfanyl-butanoic acid Openeye Name: 2-amino-2-ethyl-3-tritylsulfanyl-butanoic acid CAS Name: 2-amino-2-ethyl-3-[(triphenylmethyl)thio]butanoic acid IUPAC Name: 2-amino-2-ethyl-3-tritylsulfanylbutanoic acid Traditional Name: 2-amino-2-ethyl-3-(tritylthio)butyric acid Formula: C25H27NO2S MolecularWeight: 405.55238

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(C)SC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)(C(=O)O)N

Isomeric SMILES

CCC(C(C)SC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)(C(=O)O)N

InChI

InChI=1S/C25H27NO2S/c1-3-24(26,23(27)28)19(2)29-25(20-13-7-4-8-14-20,21-15-9-5-10-16-21)22-17-11-6-12-18-22/h4-19H,3,26H2,1-2H3,(H,27,28)