1-[[5-[(2,5-dimethylphenyl)methylsulfanyl]-4-methyl-1,2,4-triazol-3-yl]methyl]benzotriazole

Systemtic Name: 1-[[5-[(2,5-dimethylphenyl)methylsulfanyl]-4-methyl-1,2,4-triazol-3-yl]methyl]benzotriazole Openeye Name: 1-[[5-[(2,5-dimethylphenyl)methylsulfanyl]-4-methyl-1,2,4-triazol-3-yl]methyl]benzotriazole CAS Name: 1-[[5-[(2,5-dimethylphenyl)methylthio]-4-methyl-1,2,4-triazol-3-yl]methyl]benzotriazole IUPAC Name: 1-[[5-[(2,5-dimethylphenyl)methylsulfanyl]-4-methyl-1,2,4-triazol-3-yl]methyl]benzotriazole Traditional Name: 1-[[5-[(2,5-dimethylbenzyl)thio]-4-methyl-1,2,4-triazol-3-yl]methyl]benzotriazole Formula: C19H20N6S MolecularWeight: 364.4673

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)CSC2=NN=C(N2C)CN3C4=CC=CC=C4N=N3

Isomeric SMILES

CC1=CC(=C(C=C1)C)CSC2=NN=C(N2C)CN3C4=CC=CC=C4N=N3

InChI

InChI=1S/C19H20N6S/c1-13-8-9-14(2)15(10-13)12-26-19-22-21-18(24(19)3)11-25-17-7-5-4-6-16(17)20-23-25/h4-10H,11-12H2,1-3H3