3-[(6-methylquinolin-8-yl)methyl]-1,3,4-thiadiazol-3-ium-2-amine

Systemtic Name: 3-[(6-methylquinolin-8-yl)methyl]-1,3,4-thiadiazol-3-ium-2-amine Openeye Name: 3-[(6-methyl-8-quinolyl)methyl]-1,3,4-thiadiazol-3-ium-2-amine CAS Name: 3-[(6-methyl-8-quinolinyl)methyl]-1,3,4-thiadiazol-3-ium-2-amine IUPAC Name: 3-[(6-methylquinolin-8-yl)methyl]-1,3,4-thiadiazol-3-ium-2-amine Traditional Name: [3-[(6-methyl-8-quinolyl)methyl]-1,3,4-thiadiazol-3-ium-2-yl]amine Formula: C13H13N4S+ MolecularWeight: 257.33412

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C=CC=N2)C[N+]3=C(SC=N3)N

Isomeric SMILES

CC1=CC(=C2C(=C1)C=CC=N2)C[N+]3=C(SC=N3)N

InChI

InChI=1S/C13H12N4S/c1-9-5-10-3-2-4-15-12(10)11(6-9)7-17-13(14)18-8-16-17/h2-6,8,14H,7H2,1H3/p+1