2-tert-butyl-4-chloranyl-5-[2-[2-chloranyl-4-(1,3-dioxolan-2-ylmethyl)-6-methyl-phenoxy]ethylsulfanyl]pyridazin-3-one

Systemtic Name: 2-tert-butyl-4-chloranyl-5-[2-[2-chloranyl-4-(1,3-dioxolan-2-ylmethyl)-6-methyl-phenoxy]ethylsulfanyl]pyridazin-3-one Openeye Name: 2-tert-butyl-4-chloro-5-[2-[2-chloro-4-(1,3-dioxolan-2-ylmethyl)-6-methyl-phenoxy]ethylsulfanyl]pyridazin-3-one CAS Name: 2-tert-butyl-4-chloro-5-[2-[2-chloro-4-(1,3-dioxolan-2-ylmethyl)-6-methylphenoxy]ethylthio]-3-pyridazinone IUPAC Name: 2-tert-butyl-4-chloro-5-[2-[2-chloro-4-(1,3-dioxolan-2-ylmethyl)-6-methylphenoxy]ethylsulfanyl]pyridazin-3-one Traditional Name: 2-tert-butyl-4-chloro-5-[2-[2-chloro-4-(1,3-dioxolan-2-ylmethyl)-6-methyl-phenoxy]ethylthio]pyridazin-3-one Formula: C21H26Cl2N2O4S MolecularWeight: 473.41314

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)CC2OCCO2)Cl)OCCSC3=C(C(=O)N(N=C3)C(C)(C)C)Cl

Isomeric SMILES

CC1=C(C(=CC(=C1)CC2OCCO2)Cl)OCCSC3=C(C(=O)N(N=C3)C(C)(C)C)Cl

InChI

InChI=1S/C21H26Cl2N2O4S/c1-13-9-14(11-17-27-5-6-28-17)10-15(22)19(13)29-7-8-30-16-12-24-25(21(2,3)4)20(26)18(16)23/h9-10,12,17H,5-8,11H2,1-4H3