4-[(2-bromanyl-4-nitro-phenyl)diazenyl]-5-methyl-2-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-4H-pyrazol-3-one

Systemtic Name: 4-[(2-bromanyl-4-nitro-phenyl)diazenyl]-5-methyl-2-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-4H-pyrazol-3-one Openeye Name: 4-(2-bromo-4-nitro-phenyl)azo-5-methyl-2-[4-(p-tolyl)thiazol-2-yl]-4H-pyrazol-3-one CAS Name: 4-(2-bromo-4-nitrophenyl)azo-5-methyl-2-[4-(4-methylphenyl)-2-thiazolyl]-4H-pyrazol-3-one IUPAC Name: 4-[(2-bromo-4-nitrophenyl)diazenyl]-5-methyl-2-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-4H-pyrazol-3-one Traditional Name: 4-(2-bromo-4-nitro-phenyl)azo-5-methyl-2-[4-(p-tolyl)thiazol-2-yl]-2-pyrazolin-3-one Formula: C20H15BrN6O3S MolecularWeight: 499.3405

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CSC(=N2)N3C(=O)C(C(=N3)C)N=NC4=C(C=C(C=C4)[N+](=O)[O-])Br

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC(=N2)N3C(=O)C(C(=N3)C)N=NC4=C(C=C(C=C4)[N+](=O)[O-])Br

InChI

InChI=1S/C20H15BrN6O3S/c1-11-3-5-13(6-4-11)17-10-31-20(22-17)26-19(28)18(12(2)25-26)24-23-16-8-7-14(27(29)30)9-15(16)21/h3-10,18H,1-2H3