4-[[4-methyl-5-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-2,1,3-benzothiadiazole

Systemtic Name: 4-[[4-methyl-5-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-2,1,3-benzothiadiazole Openeye Name: 4-[[4-methyl-5-(p-tolyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-2,1,3-benzothiadiazole CAS Name: 4-[[[4-methyl-5-(4-methylphenyl)-1,2,4-triazol-3-yl]thio]methyl]-2,1,3-benzothiadiazole IUPAC Name: 4-[[4-methyl-5-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-2,1,3-benzothiadiazole Traditional Name: 4-[[[4-methyl-5-(p-tolyl)-1,2,4-triazol-3-yl]thio]methyl]piazthiole Formula: C17H15N5S2 MolecularWeight: 353.4645

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN=C(N2C)SCC3=CC=CC4=NSN=C43

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN=C(N2C)SCC3=CC=CC4=NSN=C43

InChI

InChI=1S/C17H15N5S2/c1-11-6-8-12(9-7-11)16-18-19-17(22(16)2)23-10-13-4-3-5-14-15(13)21-24-20-14/h3-9H,10H2,1-2H3