4-(2-methylphenyl)-3-(phenoxymethyl)-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-(2-methylphenyl)-3-(phenoxymethyl)-1H-1,2,4-triazole-5-thione Openeye Name: 4-(o-tolyl)-3-(phenoxymethyl)-1H-1,2,4-triazole-5-thione CAS Name: 4-(2-methylphenyl)-3-(phenoxymethyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 4-(2-methylphenyl)-3-(phenoxymethyl)-1H-1,2,4-triazole-5-thione Traditional Name: 4-(o-tolyl)-3-(phenoxymethyl)-1H-1,2,4-triazole-5-thione Formula: C16H15N3OS MolecularWeight: 297.3748

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=NNC2=S)COC3=CC=CC=C3

Isomeric SMILES

CC1=CC=CC=C1N2C(=NNC2=S)COC3=CC=CC=C3

InChI

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