3-[3-(1,3-benzothiazol-2-yl)-5-methyl-1,2,3,4-tetrazol-3-ium-2-yl]phenol

Systemtic Name: 3-[3-(1,3-benzothiazol-2-yl)-5-methyl-1,2,3,4-tetrazol-3-ium-2-yl]phenol Openeye Name: 3-[3-(1,3-benzothiazol-2-yl)-5-methyl-tetrazol-3-ium-2-yl]phenol CAS Name: 3-[3-(1,3-benzothiazol-2-yl)-5-methyl-2-tetrazol-3-iumyl]phenol IUPAC Name: 3-[3-(1,3-benzothiazol-2-yl)-5-methyltetrazol-3-ium-2-yl]phenol Traditional Name: 3-[3-(1,3-benzothiazol-2-yl)-5-methyl-tetrazol-3-ium-2-yl]phenol Formula: C15H12N5OS+ MolecularWeight: 310.35368

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN([N+](=N1)C2=NC3=CC=CC=C3S2)C4=CC(=CC=C4)O

Isomeric SMILES

CC1=NN([N+](=N1)C2=NC3=CC=CC=C3S2)C4=CC(=CC=C4)O

InChI

InChI=1S/C15H11N5OS/c1-10-17-19(11-5-4-6-12(21)9-11)20(18-10)15-16-13-7-2-3-8-14(13)22-15/h2-9H,1H3/p+1