4-[[(5-bromanylquinolin-8-yl)amino]methylidene]-5-methyl-2-phenyl-pyrazole-3-thione

Systemtic Name: 4-[[(5-bromanylquinolin-8-yl)amino]methylidene]-5-methyl-2-phenyl-pyrazole-3-thione Openeye Name: 4-[[(5-bromo-8-quinolyl)amino]methylene]-5-methyl-2-phenyl-pyrazole-3-thione CAS Name: 4-[[(5-bromo-8-quinolinyl)amino]methylidene]-5-methyl-2-phenyl-3-pyrazolethione IUPAC Name: 4-[[(5-bromoquinolin-8-yl)amino]methylidene]-5-methyl-2-phenylpyrazole-3-thione Traditional Name: 4-[[(5-bromo-8-quinolyl)amino]methylene]-5-methyl-2-phenyl-2-pyrazoline-3-thione Formula: C20H15BrN4S MolecularWeight: 423.3289

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=S)C1=CNC2=C3C(=C(C=C2)Br)C=CC=N3)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=S)C1=CNC2=C3C(=C(C=C2)Br)C=CC=N3)C4=CC=CC=C4

InChI

InChI=1S/C20H15BrN4S/c1-13-16(20(26)25(24-13)14-6-3-2-4-7-14)12-23-18-10-9-17(21)15-8-5-11-22-19(15)18/h2-12,23H,1H3