5-(4-methoxyphenyl)-4-methyl-N-phenyl-1,3,4-thiadiazol-4-ium-2-amine

Systemtic Name: 5-(4-methoxyphenyl)-4-methyl-N-phenyl-1,3,4-thiadiazol-4-ium-2-amine Openeye Name: 5-(4-methoxyphenyl)-4-methyl-N-phenyl-1,3,4-thiadiazol-4-ium-2-amine CAS Name: 5-(4-methoxyphenyl)-4-methyl-N-phenyl-1,3,4-thiadiazol-4-ium-2-amine IUPAC Name: 5-(4-methoxyphenyl)-4-methyl-N-phenyl-1,3,4-thiadiazol-4-ium-2-amine Traditional Name: [5-(4-methoxyphenyl)-4-methyl-1,3,4-thiadiazol-4-ium-2-yl]-phenyl-amine Formula: C16H16N3OS+ MolecularWeight: 298.38274

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(SC(=N1)NC2=CC=CC=C2)C3=CC=C(C=C3)OC

Isomeric SMILES

C[N+]1=C(SC(=N1)NC2=CC=CC=C2)C3=CC=C(C=C3)OC

InChI

InChI=1S/C16H16N3OS/c1-19-15(12-8-10-14(20-2)11-9-12)21-16(18-19)17-13-6-4-3-5-7-13/h3-11H,1-2H3,(H,17,18)/q+1