5-(4-chlorophenyl)-2-(hydroxymethyl)-4-(phenylmethyl)-1,2,4-triazole-3-thione

Systemtic Name: 5-(4-chlorophenyl)-2-(hydroxymethyl)-4-(phenylmethyl)-1,2,4-triazole-3-thione Openeye Name: 4-benzyl-5-(4-chlorophenyl)-2-(hydroxymethyl)-1,2,4-triazole-3-thione CAS Name: 5-(4-chlorophenyl)-2-(hydroxymethyl)-4-(phenylmethyl)-1,2,4-triazole-3-thione IUPAC Name: 4-benzyl-5-(4-chlorophenyl)-2-(hydroxymethyl)-1,2,4-triazole-3-thione Traditional Name: 4-benzyl-5-(4-chlorophenyl)-2-methylol-1,2,4-triazole-3-thione Formula: C16H14ClN3OS MolecularWeight: 331.81986

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=NN(C2=S)CO)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=NN(C2=S)CO)C3=CC=C(C=C3)Cl

InChI

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