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

Systemtic Name: 5-methyl-2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-4-[(4-phenoxyphenyl)diazenyl]-4H-pyrazol-3-one Openeye Name: 5-methyl-2-[4-(3-nitrophenyl)thiazol-2-yl]-4-(4-phenoxyphenyl)azo-4H-pyrazol-3-one CAS Name: 5-methyl-2-[4-(3-nitrophenyl)-2-thiazolyl]-4-(4-phenoxyphenyl)azo-4H-pyrazol-3-one IUPAC Name: 5-methyl-2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-4-[(4-phenoxyphenyl)diazenyl]-4H-pyrazol-3-one Traditional Name: 5-methyl-2-[4-(3-nitrophenyl)thiazol-2-yl]-4-(4-phenoxyphenyl)azo-2-pyrazolin-3-one Formula: C25H18N6O4S MolecularWeight: 498.51322

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1N=NC2=CC=C(C=C2)OC3=CC=CC=C3)C4=NC(=CS4)C5=CC(=CC=C5)[N+](=O)[O-]

Isomeric SMILES

CC1=NN(C(=O)C1N=NC2=CC=C(C=C2)OC3=CC=CC=C3)C4=NC(=CS4)C5=CC(=CC=C5)[N+](=O)[O-]

InChI

InChI=1S/C25H18N6O4S/c1-16-23(28-27-18-10-12-21(13-11-18)35-20-8-3-2-4-9-20)24(32)30(29-16)25-26-22(15-36-25)17-6-5-7-19(14-17)31(33)34/h2-15,23H,1H3