O-[6-[3,5-bis(chloranyl)-4-methyl-phenyl]-3-morpholin-4-yl-pyridazin-4-yl] methanethioate

Systemtic Name: O-[6-[3,5-bis(chloranyl)-4-methyl-phenyl]-3-morpholin-4-yl-pyridazin-4-yl] methanethioate Openeye Name: O-[6-(3,5-dichloro-4-methyl-phenyl)-3-morpholino-pyridazin-4-yl] methanethioate CAS Name: methanethioic acid O-[6-(3,5-dichloro-4-methylphenyl)-3-(4-morpholinyl)-4-pyridazinyl] ester IUPAC Name: O-[6-(3,5-dichloro-4-methylphenyl)-3-morpholin-4-ylpyridazin-4-yl] methanethioate Traditional Name: methanethioic acid O-[6-(3,5-dichloro-4-methyl-phenyl)-3-morpholino-pyridazin-4-yl] ester Formula: C16H15Cl2N3O2S MolecularWeight: 384.2802

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1Cl)C2=NN=C(C(=C2)OC=S)N3CCOCC3)Cl

Isomeric SMILES

CC1=C(C=C(C=C1Cl)C2=NN=C(C(=C2)OC=S)N3CCOCC3)Cl

InChI

InChI=1S/C16H15Cl2N3O2S/c1-10-12(17)6-11(7-13(10)18)14-8-15(23-9-24)16(20-19-14)21-2-4-22-5-3-21/h6-9H,2-5H2,1H3