4-(3-chloranyl-2-methyl-phenyl)-3-(phenylmethyl)-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-(3-chloranyl-2-methyl-phenyl)-3-(phenylmethyl)-1H-1,2,4-triazole-5-thione Openeye Name: 3-benzyl-4-(3-chloro-2-methyl-phenyl)-1H-1,2,4-triazole-5-thione CAS Name: 4-(3-chloro-2-methylphenyl)-3-(phenylmethyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 3-benzyl-4-(3-chloro-2-methylphenyl)-1H-1,2,4-triazole-5-thione Traditional Name: 3-benzyl-4-(3-chloro-2-methyl-phenyl)-1H-1,2,4-triazole-5-thione Formula: C16H14ClN3S MolecularWeight: 315.82046

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)N2C(=NNC2=S)CC3=CC=CC=C3

Isomeric SMILES

CC1=C(C=CC=C1Cl)N2C(=NNC2=S)CC3=CC=CC=C3

InChI

InChI=1S/C16H14ClN3S/c1-11-13(17)8-5-9-14(11)20-15(18-19-16(20)21)10-12-6-3-2-4-7-12/h2-9H,10H2,1H3,(H,19,21)