5-(4-methoxyphenyl)-3-methyl-1,3,4-thiadiazol-3-ium

Systemtic Name: 5-(4-methoxyphenyl)-3-methyl-1,3,4-thiadiazol-3-ium Openeye Name: 5-(4-methoxyphenyl)-3-methyl-1,3,4-thiadiazol-3-ium CAS Name: 5-(4-methoxyphenyl)-3-methyl-1,3,4-thiadiazol-3-ium IUPAC Name: 5-(4-methoxyphenyl)-3-methyl-1,3,4-thiadiazol-3-ium Traditional Name: 5-(4-methoxyphenyl)-3-methyl-1,3,4-thiadiazol-3-ium Formula: C10H11N2OS+ MolecularWeight: 207.27214

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H11N2OS/c1-12-7-14-10(11-12)8-3-5-9(13-2)6-4-8/h3-7H,1-2H3/q+1