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

Systemtic Name: 3-[(4-chloranylphenoxy)methyl]-4-(phenylmethyl)-1H-1,2,4-triazole-5-thione Openeye Name: 4-benzyl-3-[(4-chlorophenoxy)methyl]-1H-1,2,4-triazole-5-thione CAS Name: 3-[(4-chlorophenoxy)methyl]-4-(phenylmethyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 4-benzyl-3-[(4-chlorophenoxy)methyl]-1H-1,2,4-triazole-5-thione Traditional Name: 4-benzyl-3-[(4-chlorophenoxy)methyl]-1H-1,2,4-triazole-5-thione Formula: C16H14ClN3OS MolecularWeight: 331.81986

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=NNC2=S)COC3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=NNC2=S)COC3=CC=C(C=C3)Cl

InChI

InChI=1S/C16H14ClN3OS/c17-13-6-8-14(9-7-13)21-11-15-18-19-16(22)20(15)10-12-4-2-1-3-5-12/h1-9H,10-11H2,(H,19,22)