5-(4-methoxyphenyl)-2-(phenylmethyl)-1H-1,2,4-triazole-3-thione

Systemtic Name: 5-(4-methoxyphenyl)-2-(phenylmethyl)-1H-1,2,4-triazole-3-thione Openeye Name: 2-benzyl-5-(4-methoxyphenyl)-1H-1,2,4-triazole-3-thione CAS Name: 5-(4-methoxyphenyl)-2-(phenylmethyl)-1H-1,2,4-triazole-3-thione IUPAC Name: 2-benzyl-5-(4-methoxyphenyl)-1H-1,2,4-triazole-3-thione Traditional Name: 2-benzyl-5-(4-methoxyphenyl)-1H-1,2,4-triazole-3-thione Formula: C16H15N3OS MolecularWeight: 297.3748

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NC(=S)N(N2)CC3=CC=CC=C3

Isomeric SMILES

COC1=CC=C(C=C1)C2=NC(=S)N(N2)CC3=CC=CC=C3

InChI

InChI=1S/C16H15N3OS/c1-20-14-9-7-13(8-10-14)15-17-16(21)19(18-15)11-12-5-3-2-4-6-12/h2-10H,11H2,1H3,(H,17,18,21)