4-(2-chlorophenyl)-3-phenethyl-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-(2-chlorophenyl)-3-phenethyl-1H-1,2,4-triazole-5-thione Openeye Name: 4-(2-chlorophenyl)-3-phenethyl-1H-1,2,4-triazole-5-thione CAS Name: 4-(2-chlorophenyl)-3-phenethyl-1H-1,2,4-triazole-5-thione IUPAC Name: 4-(2-chlorophenyl)-3-phenethyl-1H-1,2,4-triazole-5-thione Traditional Name: 4-(2-chlorophenyl)-3-phenethyl-1H-1,2,4-triazole-5-thione Formula: C16H14ClN3S MolecularWeight: 315.82046

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC2=NNC(=S)N2C3=CC=CC=C3Cl

Isomeric SMILES

C1=CC=C(C=C1)CCC2=NNC(=S)N2C3=CC=CC=C3Cl

InChI

InChI=1S/C16H14ClN3S/c17-13-8-4-5-9-14(13)20-15(18-19-16(20)21)11-10-12-6-2-1-3-7-12/h1-9H,10-11H2,(H,19,21)