4-imidazol-1-yl-5-methylsulfanyl-1-propyl-3-[2,4,5-tris(chloranyl)phenyl]pyrazole

Systemtic Name: 4-imidazol-1-yl-5-methylsulfanyl-1-propyl-3-[2,4,5-tris(chloranyl)phenyl]pyrazole Openeye Name: 4-imidazol-1-yl-5-methylsulfanyl-1-propyl-3-(2,4,5-trichlorophenyl)pyrazole CAS Name: 4-(1-imidazolyl)-5-(methylthio)-1-propyl-3-(2,4,5-trichlorophenyl)pyrazole IUPAC Name: 4-imidazol-1-yl-5-methylsulfanyl-1-propyl-3-(2,4,5-trichlorophenyl)pyrazole Traditional Name: 4-imidazol-1-yl-5-(methylthio)-1-propyl-3-(2,4,5-trichlorophenyl)pyrazole Formula: C16H15Cl3N4S MolecularWeight: 401.7411

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C(C(=N1)C2=CC(=C(C=C2Cl)Cl)Cl)N3C=CN=C3)SC

Isomeric SMILES

CCCN1C(=C(C(=N1)C2=CC(=C(C=C2Cl)Cl)Cl)N3C=CN=C3)SC

InChI

InChI=1S/C16H15Cl3N4S/c1-3-5-23-16(24-2)15(22-6-4-20-9-22)14(21-23)10-7-12(18)13(19)8-11(10)17/h4,6-9H,3,5H2,1-2H3