2-[(1,2-diphenyl-5H-pyrazolo[1,2-a]benzotriazol-10-ium-3-yl)sulfanyl]ethanol

Systemtic Name: 2-[(1,2-diphenyl-5H-pyrazolo[1,2-a]benzotriazol-10-ium-3-yl)sulfanyl]ethanol Openeye Name: 2-[(1,2-diphenyl-5H-pyrazolo[1,2-a]benzotriazol-10-ium-3-yl)sulfanyl]ethanol CAS Name: 2-[(1,2-diphenyl-5H-pyrazolo[1,2-a]benzotriazol-10-ium-3-yl)thio]ethanol IUPAC Name: 2-[(1,2-diphenyl-5H-pyrazolo[1,2-a]benzotriazol-10-ium-3-yl)sulfanyl]ethanol Traditional Name: 2-[(1,2-diphenyl-5H-pyrazolo[1,2-a]benzotriazol-10-ium-3-yl)thio]ethanol Formula: C23H20N3OS+ MolecularWeight: 386.4894

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(N3NC4=CC=CC=C4[N+]3=C2C5=CC=CC=C5)SCCO

Isomeric SMILES

C1=CC=C(C=C1)C2=C(N3NC4=CC=CC=C4[N+]3=C2C5=CC=CC=C5)SCCO

InChI

InChI=1S/C23H20N3OS/c27-15-16-28-23-21(17-9-3-1-4-10-17)22(18-11-5-2-6-12-18)25-20-14-8-7-13-19(20)24-26(23)25/h1-14,24,27H,15-16H2/q+1