5-phenyl-3-propan-2-yl-1,2,3,4-thiatriazol-3-ium

Systemtic Name: 5-phenyl-3-propan-2-yl-1,2,3,4-thiatriazol-3-ium Openeye Name: 3-isopropyl-5-phenyl-thiatriazol-3-ium CAS Name: 5-phenyl-3-propan-2-ylthiatriazol-3-ium IUPAC Name: 5-phenyl-3-propan-2-ylthiatriazol-3-ium Traditional Name: 3-isopropyl-5-phenyl-thiatriazol-3-ium Formula: C10H12N3S+ MolecularWeight: 206.28738

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[N+]1=NSC(=N1)C2=CC=CC=C2

Isomeric SMILES

CC(C)[N+]1=NSC(=N1)C2=CC=CC=C2

InChI

InChI=1S/C10H12N3S/c1-8(2)13-11-10(14-12-13)9-6-4-3-5-7-9/h3-8H,1-2H3/q+1