1-methyl-3-(phenylsulfanylmethyl)benzotriazol-1-ium

Systemtic Name: 1-methyl-3-(phenylsulfanylmethyl)benzotriazol-1-ium Openeye Name: 1-methyl-3-(phenylsulfanylmethyl)benzotriazol-1-ium CAS Name: 1-methyl-3-[(phenylthio)methyl]benzotriazol-1-ium IUPAC Name: 1-methyl-3-(phenylsulfanylmethyl)benzotriazol-1-ium Traditional Name: 1-methyl-3-[(phenylthio)methyl]benzotriazol-1-ium Formula: C14H14N3S+ MolecularWeight: 256.34606

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=NN(C2=CC=CC=C21)CSC3=CC=CC=C3

Isomeric SMILES

C[N+]1=NN(C2=CC=CC=C21)CSC3=CC=CC=C3

InChI

InChI=1S/C14H14N3S/c1-16-13-9-5-6-10-14(13)17(15-16)11-18-12-7-3-2-4-8-12/h2-10H,11H2,1H3/q+1