[4-chloranyl-3-(3-chloranyl-2-nitro-phenyl)pyrazol-1-yl]methyl thiocyanate

Systemtic Name: [4-chloranyl-3-(3-chloranyl-2-nitro-phenyl)pyrazol-1-yl]methyl thiocyanate Openeye Name: [4-chloro-3-(3-chloro-2-nitro-phenyl)pyrazol-1-yl]methyl thiocyanate CAS Name: thiocyanic acid [4-chloro-3-(3-chloro-2-nitrophenyl)-1-pyrazolyl]methyl ester IUPAC Name: [4-chloro-3-(3-chloro-2-nitrophenyl)pyrazol-1-yl]methyl thiocyanate Traditional Name: thiocyanic acid [4-chloro-3-(3-chloro-2-nitro-phenyl)pyrazol-1-yl]methyl ester Formula: C11H6Cl2N4O2S MolecularWeight: 329.16194

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)Cl)[N+](=O)[O-])C2=NN(C=C2Cl)CSC#N

Isomeric SMILES

C1=CC(=C(C(=C1)Cl)[N+](=O)[O-])C2=NN(C=C2Cl)CSC#N

InChI

InChI=1S/C11H6Cl2N4O2S/c12-8-3-1-2-7(11(8)17(18)19)10-9(13)4-16(15-10)6-20-5-14/h1-4H,6H2