4-(2-bromanyl-4-methyl-phenyl)-5-quinolin-2-yl-1,2,4-triazole-3-thiolate

Systemtic Name: 4-(2-bromanyl-4-methyl-phenyl)-5-quinolin-2-yl-1,2,4-triazole-3-thiolate Openeye Name: 4-(2-bromo-4-methyl-phenyl)-5-(2-quinolyl)-1,2,4-triazole-3-thiolate CAS Name: 4-(2-bromo-4-methylphenyl)-5-(2-quinolinyl)-1,2,4-triazole-3-thiolate IUPAC Name: 4-(2-bromo-4-methylphenyl)-5-quinolin-2-yl-1,2,4-triazole-3-thiolate Traditional Name: 4-(2-bromo-4-methyl-phenyl)-5-(2-quinolyl)-1,2,4-triazole-3-thiolate Formula: C18H12BrN4S- MolecularWeight: 396.28368

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2C(=NN=C2[S-])C3=NC4=CC=CC=C4C=C3)Br

Isomeric SMILES

CC1=CC(=C(C=C1)N2C(=NN=C2[S-])C3=NC4=CC=CC=C4C=C3)Br

InChI

InChI=1S/C18H13BrN4S/c1-11-6-9-16(13(19)10-11)23-17(21-22-18(23)24)15-8-7-12-4-2-3-5-14(12)20-15/h2-10H,1H3,(H,22,24)/p-1