S-[2-[1-(triphenylmethyl)-1,2,3-triazol-4-yl]ethylsulfanylmethyl] ethanethioate

Systemtic Name: S-[2-[1-(triphenylmethyl)-1,2,3-triazol-4-yl]ethylsulfanylmethyl] ethanethioate Openeye Name: S-[2-(1-trityltriazol-4-yl)ethylsulfanylmethyl] ethanethioate CAS Name: ethanethioic acid S-[[2-[1-(triphenylmethyl)-4-triazolyl]ethylthio]methyl] ester IUPAC Name: S-[2-(1-trityltriazol-4-yl)ethylsulfanylmethyl] ethanethioate Traditional Name: ethanethioic acid S-[[2-(1-trityltriazol-4-yl)ethylthio]methyl] ester Formula: C26H25N3OS2 MolecularWeight: 459.6262

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCSCCC1=CN(N=N1)C(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(=O)SCSCCC1=CN(N=N1)C(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C26H25N3OS2/c1-21(30)32-20-31-18-17-25-19-29(28-27-25)26(22-11-5-2-6-12-22,23-13-7-3-8-14-23)24-15-9-4-10-16-24/h2-16,19H,17-18,20H2,1H3