5-[2-(4-chlorophenyl)sulfanyl-5-nitro-phenyl]-1H-pyrazole

Systemtic Name: 5-[2-(4-chlorophenyl)sulfanyl-5-nitro-phenyl]-1H-pyrazole Openeye Name: 5-[2-(4-chlorophenyl)sulfanyl-5-nitro-phenyl]-1H-pyrazole CAS Name: 5-[2-[(4-chlorophenyl)thio]-5-nitrophenyl]-1H-pyrazole IUPAC Name: 5-[2-(4-chlorophenyl)sulfanyl-5-nitrophenyl]-1H-pyrazole Traditional Name: 5-[2-[(4-chlorophenyl)thio]-5-nitro-phenyl]-1H-pyrazole Formula: C15H10ClN3O2S MolecularWeight: 331.7768

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1SC2=C(C=C(C=C2)[N+](=O)[O-])C3=CC=NN3)Cl

Isomeric SMILES

C1=CC(=CC=C1SC2=C(C=C(C=C2)[N+](=O)[O-])C3=CC=NN3)Cl

InChI

InChI=1S/C15H10ClN3O2S/c16-10-1-4-12(5-2-10)22-15-6-3-11(19(20)21)9-13(15)14-7-8-17-18-14/h1-9H,(H,17,18)