4-chloranyl-N-(2-methylsulfanylphenyl)-3-nitro-1H-pyrazole-5-carboxamide

Systemtic Name: 4-chloranyl-N-(2-methylsulfanylphenyl)-3-nitro-1H-pyrazole-5-carboxamide Openeye Name: 4-chloro-N-(2-methylsulfanylphenyl)-3-nitro-1H-pyrazole-5-carboxamide CAS Name: 4-chloro-N-[2-(methylthio)phenyl]-3-nitro-1H-pyrazole-5-carboxamide IUPAC Name: 4-chloro-N-(2-methylsulfanylphenyl)-3-nitro-1H-pyrazole-5-carboxamide Traditional Name: 4-chloro-N-[2-(methylthio)phenyl]-3-nitro-1H-pyrazole-5-carboxamide Formula: C11H9ClN4O3S MolecularWeight: 312.73216

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1NC(=O)C2=C(C(=NN2)[N+](=O)[O-])Cl

Isomeric SMILES

CSC1=CC=CC=C1NC(=O)C2=C(C(=NN2)[N+](=O)[O-])Cl

InChI

InChI=1S/C11H9ClN4O3S/c1-20-7-5-3-2-4-6(7)13-11(17)9-8(12)10(15-14-9)16(18)19/h2-5H,1H3,(H,13,17)(H,14,15)