2-tert-butyl-4-chloranyl-5-[2-[4-(2-methoxyethyl)-2-methyl-phenoxy]ethylsulfanyl]pyridazin-3-one

Systemtic Name: 2-tert-butyl-4-chloranyl-5-[2-[4-(2-methoxyethyl)-2-methyl-phenoxy]ethylsulfanyl]pyridazin-3-one Openeye Name: 2-tert-butyl-4-chloro-5-[2-[4-(2-methoxyethyl)-2-methyl-phenoxy]ethylsulfanyl]pyridazin-3-one CAS Name: 2-tert-butyl-4-chloro-5-[2-[4-(2-methoxyethyl)-2-methylphenoxy]ethylthio]-3-pyridazinone IUPAC Name: 2-tert-butyl-4-chloro-5-[2-[4-(2-methoxyethyl)-2-methylphenoxy]ethylsulfanyl]pyridazin-3-one Traditional Name: 2-tert-butyl-4-chloro-5-[2-[4-(2-methoxyethyl)-2-methyl-phenoxy]ethylthio]pyridazin-3-one Formula: C20H27ClN2O3S MolecularWeight: 410.95798

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)CCOC)OCCSC2=C(C(=O)N(N=C2)C(C)(C)C)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)CCOC)OCCSC2=C(C(=O)N(N=C2)C(C)(C)C)Cl

InChI

InChI=1S/C20H27ClN2O3S/c1-14-12-15(8-9-25-5)6-7-16(14)26-10-11-27-17-13-22-23(20(2,3)4)19(24)18(17)21/h6-7,12-13H,8-11H2,1-5H3