1-(6-chloranyl-3-phenyl-pyridazin-4-yl)octan-4-yloxymethanethioic S-acid

Systemtic Name: 1-(6-chloranyl-3-phenyl-pyridazin-4-yl)octan-4-yloxymethanethioic S-acid Openeye Name: 1-[3-(6-chloro-3-phenyl-pyridazin-4-yl)propyl]pentoxymethanethioic S-acid CAS Name: 1-(6-chloro-3-phenyl-4-pyridazinyl)octan-4-yloxymethanethioic S-acid IUPAC Name: 1-(6-chloro-3-phenylpyridazin-4-yl)octan-4-yloxymethanethioic S-acid Traditional Name: 1-[3-(6-chloro-3-phenyl-pyridazin-4-yl)propyl]pentoxythioformic acid Formula: C19H23ClN2O2S MolecularWeight: 378.91612

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CCCC1=CC(=NN=C1C2=CC=CC=C2)Cl)OC(=O)S

Isomeric SMILES

CCCCC(CCCC1=CC(=NN=C1C2=CC=CC=C2)Cl)OC(=O)S

InChI

InChI=1S/C19H23ClN2O2S/c1-2-3-11-16(24-19(23)25)12-7-10-15-13-17(20)21-22-18(15)14-8-5-4-6-9-14/h4-6,8-9,13,16H,2-3,7,10-12H2,1H3,(H,23,25)