4-(4-bromanyl-2-chloranyl-phenyl)-3-(5-cyclopropyl-1H-pyrazol-3-yl)-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-(4-bromanyl-2-chloranyl-phenyl)-3-(5-cyclopropyl-1H-pyrazol-3-yl)-1H-1,2,4-triazole-5-thione Openeye Name: 4-(4-bromo-2-chloro-phenyl)-3-(5-cyclopropyl-1H-pyrazol-3-yl)-1H-1,2,4-triazole-5-thione CAS Name: 4-(4-bromo-2-chlorophenyl)-3-(5-cyclopropyl-1H-pyrazol-3-yl)-1H-1,2,4-triazole-5-thione IUPAC Name: 4-(4-bromo-2-chlorophenyl)-3-(5-cyclopropyl-1H-pyrazol-3-yl)-1H-1,2,4-triazole-5-thione Traditional Name: 4-(4-bromo-2-chloro-phenyl)-3-(5-cyclopropyl-1H-pyrazol-3-yl)-1H-1,2,4-triazole-5-thione Formula: C14H11BrClN5S MolecularWeight: 396.69264

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=CC(=NN2)C3=NNC(=S)N3C4=C(C=C(C=C4)Br)Cl

Isomeric SMILES

C1CC1C2=CC(=NN2)C3=NNC(=S)N3C4=C(C=C(C=C4)Br)Cl

InChI

InChI=1S/C14H11BrClN5S/c15-8-3-4-12(9(16)5-8)21-13(19-20-14(21)22)11-6-10(17-18-11)7-1-2-7/h3-7H,1-2H2,(H,17,18)(H,20,22)