5-(4-methoxy-2,3-dimethyl-phenyl)-4-methyl-N-phenyl-1,3,4-thiadiazol-4-ium-2-amine chloride

Systemtic Name: 5-(4-methoxy-2,3-dimethyl-phenyl)-4-methyl-N-phenyl-1,3,4-thiadiazol-4-ium-2-amine chloride Openeye Name: 5-(4-methoxy-2,3-dimethyl-phenyl)-4-methyl-N-phenyl-1,3,4-thiadiazol-4-ium-2-amine chloride CAS Name: 5-(4-methoxy-2,3-dimethylphenyl)-4-methyl-N-phenyl-1,3,4-thiadiazol-4-ium-2-amine chloride IUPAC Name: 5-(4-methoxy-2,3-dimethylphenyl)-4-methyl-N-phenyl-1,3,4-thiadiazol-4-ium-2-amine chloride Traditional Name: [5-(4-methoxy-2,3-dimethyl-phenyl)-4-methyl-1,3,4-thiadiazol-4-ium-2-yl]-phenyl-amine chloride Formula: C18H20ClN3OS MolecularWeight: 361.8889

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1C)OC)C2=[N+](N=C(S2)NC3=CC=CC=C3)C.[Cl-]

Isomeric SMILES

CC1=C(C=CC(=C1C)OC)C2=[N+](N=C(S2)NC3=CC=CC=C3)C.[Cl-]

InChI

InChI=1S/C18H20N3OS.ClH/c1-12-13(2)16(22-4)11-10-15(12)17-21(3)20-18(23-17)19-14-8-6-5-7-9-14;/h5-11H,1-4H3,(H,19,20);1H/q+1;/p-1