4-[[2,6-bis(chloranyl)-4-nitro-phenyl]hydrazinylidene]-3-methyl-5-oxidanylidene-pyrazole-1-carbothioamide

Systemtic Name: 4-[[2,6-bis(chloranyl)-4-nitro-phenyl]hydrazinylidene]-3-methyl-5-oxidanylidene-pyrazole-1-carbothioamide Openeye Name: 4-[(2,6-dichloro-4-nitro-phenyl)hydrazono]-3-methyl-5-oxo-pyrazole-1-carbothioamide CAS Name: 4-[(2,6-dichloro-4-nitrophenyl)hydrazinylidene]-3-methyl-5-oxo-1-pyrazolecarbothioamide IUPAC Name: 4-[(2,6-dichloro-4-nitrophenyl)hydrazinylidene]-3-methyl-5-oxopyrazole-1-carbothioamide Traditional Name: 4-[(2,6-dichloro-4-nitro-phenyl)hydrazono]-5-keto-3-methyl-2-pyrazoline-1-carbothioamide Formula: C11H8Cl2N6O3S MolecularWeight: 375.19062

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=NNC2=C(C=C(C=C2Cl)[N+](=O)[O-])Cl)C(=S)N

Isomeric SMILES

CC1=NN(C(=O)C1=NNC2=C(C=C(C=C2Cl)[N+](=O)[O-])Cl)C(=S)N

InChI

InChI=1S/C11H8Cl2N6O3S/c1-4-8(10(20)18(17-4)11(14)23)15-16-9-6(12)2-5(19(21)22)3-7(9)13/h2-3,16H,1H3,(H2,14,23)