[4-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)phenyl]-quinolin-8-ylsulfonyl-azanide

Systemtic Name: [4-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)phenyl]-quinolin-8-ylsulfonyl-azanide Openeye Name: [4-(4-bromo-3,5-dimethyl-pyrazol-1-yl)phenyl]-(8-quinolylsulfonyl)azanide CAS Name: [4-(4-bromo-3,5-dimethyl-1-pyrazolyl)phenyl]-(8-quinolinylsulfonyl)azanide IUPAC Name: [4-(4-bromo-3,5-dimethylpyrazol-1-yl)phenyl]-quinolin-8-ylsulfonylazanide Traditional Name: [4-(4-bromo-3,5-dimethyl-pyrazol-1-yl)phenyl]-(8-quinolylsulfonyl)azanide Formula: C20H16BrN4O2S- MolecularWeight: 456.33564

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=C(C=C2)[N-]S(=O)(=O)C3=CC=CC4=C3N=CC=C4)C)Br

Isomeric SMILES

CC1=C(C(=NN1C2=CC=C(C=C2)[N-]S(=O)(=O)C3=CC=CC4=C3N=CC=C4)C)Br

InChI

InChI=1S/C20H16BrN4O2S/c1-13-19(21)14(2)25(23-13)17-10-8-16(9-11-17)24-28(26,27)18-7-3-5-15-6-4-12-22-20(15)18/h3-12H,1-2H3/q-1