3-[(4-chloranyl-3-methyl-phenoxy)methyl]-4-(phenylmethyl)-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-[(4-chloranyl-3-methyl-phenoxy)methyl]-4-(phenylmethyl)-1H-1,2,4-triazole-5-thione Openeye Name: 4-benzyl-3-[(4-chloro-3-methyl-phenoxy)methyl]-1H-1,2,4-triazole-5-thione CAS Name: 3-[(4-chloro-3-methylphenoxy)methyl]-4-(phenylmethyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 4-benzyl-3-[(4-chloro-3-methylphenoxy)methyl]-1H-1,2,4-triazole-5-thione Traditional Name: 4-benzyl-3-[(4-chloro-3-methyl-phenoxy)methyl]-1H-1,2,4-triazole-5-thione Formula: C17H16ClN3OS MolecularWeight: 345.84644

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC2=NNC(=S)N2CC3=CC=CC=C3)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)OCC2=NNC(=S)N2CC3=CC=CC=C3)Cl

InChI

InChI=1S/C17H16ClN3OS/c1-12-9-14(7-8-15(12)18)22-11-16-19-20-17(23)21(16)10-13-5-3-2-4-6-13/h2-9H,10-11H2,1H3,(H,20,23)