O-[6-chloranyl-3-(4-chloranyl-3-nitro-phenyl)pyridazin-4-yl] pentanethioate

Systemtic Name: O-[6-chloranyl-3-(4-chloranyl-3-nitro-phenyl)pyridazin-4-yl] pentanethioate Openeye Name: O-[6-chloro-3-(4-chloro-3-nitro-phenyl)pyridazin-4-yl] pentanethioate CAS Name: pentanethioic acid O-[6-chloro-3-(4-chloro-3-nitrophenyl)-4-pyridazinyl] ester IUPAC Name: O-[6-chloro-3-(4-chloro-3-nitrophenyl)pyridazin-4-yl] pentanethioate Traditional Name: pentanethioic acid O-[6-chloro-3-(4-chloro-3-nitro-phenyl)pyridazin-4-yl] ester Formula: C15H13Cl2N3O3S MolecularWeight: 386.25302

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=S)OC1=CC(=NN=C1C2=CC(=C(C=C2)Cl)[N+](=O)[O-])Cl

Isomeric SMILES

CCCCC(=S)OC1=CC(=NN=C1C2=CC(=C(C=C2)Cl)[N+](=O)[O-])Cl

InChI

InChI=1S/C15H13Cl2N3O3S/c1-2-3-4-14(24)23-12-8-13(17)18-19-15(12)9-5-6-10(16)11(7-9)20(21)22/h5-8H,2-4H2,1H3