5-[(2,3-dimethylphenyl)amino]-3-[(4-methylpiperidin-1-ium-1-yl)methyl]-1,3,4-thiadiazole-2-thione

Systemtic Name: 5-[(2,3-dimethylphenyl)amino]-3-[(4-methylpiperidin-1-ium-1-yl)methyl]-1,3,4-thiadiazole-2-thione Openeye Name: 5-(2,3-dimethylanilino)-3-[(4-methylpiperidin-1-ium-1-yl)methyl]-1,3,4-thiadiazole-2-thione CAS Name: 5-(2,3-dimethylanilino)-3-[(4-methyl-1-piperidin-1-iumyl)methyl]-1,3,4-thiadiazole-2-thione IUPAC Name: 5-(2,3-dimethylanilino)-3-[(4-methylpiperidin-1-ium-1-yl)methyl]-1,3,4-thiadiazole-2-thione Traditional Name: 5-(2,3-dimethylanilino)-3-[(4-methylpiperidin-1-ium-1-yl)methyl]-1,3,4-thiadiazole-2-thione Formula: C17H25N4S2+ MolecularWeight: 349.5372

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)CN2C(=S)SC(=N2)NC3=CC=CC(=C3C)C

Isomeric SMILES

CC1CC[NH+](CC1)CN2C(=S)SC(=N2)NC3=CC=CC(=C3C)C

InChI

InChI=1S/C17H24N4S2/c1-12-7-9-20(10-8-12)11-21-17(22)23-16(19-21)18-15-6-4-5-13(2)14(15)3/h4-6,12H,7-11H2,1-3H3,(H,18,19)/p+1