4-[(2,4-dimethylphenyl)diazenyl]-5-methyl-2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-4H-pyrazol-3-one

Systemtic Name: 4-[(2,4-dimethylphenyl)diazenyl]-5-methyl-2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-4H-pyrazol-3-one Openeye Name: 4-(2,4-dimethylphenyl)azo-5-methyl-2-[4-(3-nitrophenyl)thiazol-2-yl]-4H-pyrazol-3-one CAS Name: 4-(2,4-dimethylphenyl)azo-5-methyl-2-[4-(3-nitrophenyl)-2-thiazolyl]-4H-pyrazol-3-one IUPAC Name: 4-[(2,4-dimethylphenyl)diazenyl]-5-methyl-2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-4H-pyrazol-3-one Traditional Name: 4-(2,4-dimethylphenyl)azo-5-methyl-2-[4-(3-nitrophenyl)thiazol-2-yl]-2-pyrazolin-3-one Formula: C21H18N6O3S MolecularWeight: 434.47102

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N=NC2C(=NN(C2=O)C3=NC(=CS3)C4=CC(=CC=C4)[N+](=O)[O-])C)C

Isomeric SMILES

CC1=CC(=C(C=C1)N=NC2C(=NN(C2=O)C3=NC(=CS3)C4=CC(=CC=C4)[N+](=O)[O-])C)C

InChI

InChI=1S/C21H18N6O3S/c1-12-7-8-17(13(2)9-12)23-24-19-14(3)25-26(20(19)28)21-22-18(11-31-21)15-5-4-6-16(10-15)27(29)30/h4-11,19H,1-3H3