2-[2-oxidanylidene-2-[2-[1-(triphenylmethyl)sulfanylimidazol-4-yl]ethylamino]ethoxy]ethanoic acid

Systemtic Name: 2-[2-oxidanylidene-2-[2-[1-(triphenylmethyl)sulfanylimidazol-4-yl]ethylamino]ethoxy]ethanoic acid Openeye Name: 2-[2-oxo-2-[2-(1-tritylsulfanylimidazol-4-yl)ethylamino]ethoxy]acetic acid CAS Name: 2-[2-oxo-2-[2-[1-[(triphenylmethyl)thio]-4-imidazolyl]ethylamino]ethoxy]acetic acid IUPAC Name: 2-[2-oxo-2-[2-(1-tritylsulfanylimidazol-4-yl)ethylamino]ethoxy]acetic acid Traditional Name: 2-[2-keto-2-[2-[1-(tritylthio)imidazol-4-yl]ethylamino]ethoxy]acetic acid Formula: C28H27N3O4S MolecularWeight: 501.59668

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)SN4C=C(N=C4)CCNC(=O)COCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)SN4C=C(N=C4)CCNC(=O)COCC(=O)O

InChI

InChI=1S/C28H27N3O4S/c32-26(19-35-20-27(33)34)29-17-16-25-18-31(21-30-25)36-28(22-10-4-1-5-11-22,23-12-6-2-7-13-23)24-14-8-3-9-15-24/h1-15,18,21H,16-17,19-20H2,(H,29,32)(H,33,34)