(4Z)-4-[(3-bromanyl-4-methyl-phenyl)hydrazinylidene]-3-(4-nitrophenyl)-5-oxidanylidene-pyrazole-1-carbothioamide

Systemtic Name: (4Z)-4-[(3-bromanyl-4-methyl-phenyl)hydrazinylidene]-3-(4-nitrophenyl)-5-oxidanylidene-pyrazole-1-carbothioamide Openeye Name: (4Z)-4-[(3-bromo-4-methyl-phenyl)hydrazono]-3-(4-nitrophenyl)-5-oxo-pyrazole-1-carbothioamide CAS Name: (4Z)-4-[(3-bromo-4-methylphenyl)hydrazinylidene]-3-(4-nitrophenyl)-5-oxo-1-pyrazolecarbothioamide IUPAC Name: (4Z)-4-[(3-bromo-4-methylphenyl)hydrazinylidene]-3-(4-nitrophenyl)-5-oxopyrazole-1-carbothioamide Traditional Name: (4Z)-4-[(3-bromo-4-methyl-phenyl)hydrazono]-5-keto-3-(4-nitrophenyl)-2-pyrazoline-1-carbothioamide Formula: C17H13BrN6O3S MolecularWeight: 461.29252

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NN=C2C(=NN(C2=O)C(=S)N)C3=CC=C(C=C3)[N+](=O)[O-])Br

Isomeric SMILES

CC1=C(C=C(C=C1)N/N=C\2/C(=NN(C2=O)C(=S)N)C3=CC=C(C=C3)[N+](=O)[O-])Br

InChI

InChI=1S/C17H13BrN6O3S/c1-9-2-5-11(8-13(9)18)20-21-15-14(22-23(16(15)25)17(19)28)10-3-6-12(7-4-10)24(26)27/h2-8,20H,1H3,(H2,19,28)/b21-15-