2,2,2-triphenyl-1-(2H-1,2,3-triazol-4-ylsulfanyl)ethanethiol

Systemtic Name: 2,2,2-triphenyl-1-(2H-1,2,3-triazol-4-ylsulfanyl)ethanethiol Openeye Name: 2,2,2-triphenyl-1-(2H-triazol-4-ylsulfanyl)ethanethiol CAS Name: 2,2,2-triphenyl-1-(2H-triazol-4-ylthio)ethanethiol IUPAC Name: 2,2,2-triphenyl-1-(2H-triazol-4-ylsulfanyl)ethanethiol Traditional Name: 2,2,2-triphenyl-1-(2H-triazol-4-ylthio)ethanethiol Formula: C22H19N3S2 MolecularWeight: 389.53636

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)C(S)SC4=NNN=C4

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)C(S)SC4=NNN=C4

InChI

InChI=1S/C22H19N3S2/c26-21(27-20-16-23-25-24-20)22(17-10-4-1-5-11-17,18-12-6-2-7-13-18)19-14-8-3-9-15-19/h1-16,21,26H,(H,23,24,25)