6-[(2,5-dimethylphenyl)sulfanylmethyl]-3-(3-methylphenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole

Systemtic Name: 6-[(2,5-dimethylphenyl)sulfanylmethyl]-3-(3-methylphenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole Openeye Name: 6-[(2,5-dimethylphenyl)sulfanylmethyl]-3-(m-tolyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole CAS Name: 6-[[(2,5-dimethylphenyl)thio]methyl]-3-(3-methylphenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole IUPAC Name: 6-[(2,5-dimethylphenyl)sulfanylmethyl]-3-(3-methylphenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole Traditional Name: 6-[[(2,5-dimethylphenyl)thio]methyl]-3-(m-tolyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole Formula: C19H18N4S2 MolecularWeight: 366.50302

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)SCC2=NN3C(=NN=C3S2)C4=CC(=CC=C4)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)SCC2=NN3C(=NN=C3S2)C4=CC(=CC=C4)C

InChI

InChI=1S/C19H18N4S2/c1-12-5-4-6-15(9-12)18-20-21-19-23(18)22-17(25-19)11-24-16-10-13(2)7-8-14(16)3/h4-10H,11H2,1-3H3