2-[(2,5-dimethyl-1,2,4-triazol-3-yl)sulfanylmethyl]-N,N-dimethyl-aniline dihydrochloride

Systemtic Name: 2-[(2,5-dimethyl-1,2,4-triazol-3-yl)sulfanylmethyl]-N,N-dimethyl-aniline dihydrochloride Openeye Name: 2-[(2,5-dimethyl-1,2,4-triazol-3-yl)sulfanylmethyl]-N,N-dimethyl-aniline dihydrochloride CAS Name: 2-[[(2,5-dimethyl-1,2,4-triazol-3-yl)thio]methyl]-N,N-dimethylaniline dihydrochloride IUPAC Name: 2-[(2,5-dimethyl-1,2,4-triazol-3-yl)sulfanylmethyl]-N,N-dimethylaniline dihydrochloride Traditional Name: [2-[[(2,5-dimethyl-1,2,4-triazol-3-yl)thio]methyl]phenyl]-dimethyl-amine dihydrochloride Formula: C13H20Cl2N4S MolecularWeight: 335.2957

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=N1)SCC2=CC=CC=C2N(C)C)C.Cl.Cl

Isomeric SMILES

CC1=NN(C(=N1)SCC2=CC=CC=C2N(C)C)C.Cl.Cl

InChI

InChI=1S/C13H18N4S.2ClH/c1-10-14-13(17(4)15-10)18-9-11-7-5-6-8-12(11)16(2)3;;/h5-8H,9H2,1-4H3;2*1H