2-tert-butyl-5-[(4-tert-butylcyclohex-2-en-1-yl)methylsulfanyl]-4-chloranyl-pyridazin-3-one

Systemtic Name: 2-tert-butyl-5-[(4-tert-butylcyclohex-2-en-1-yl)methylsulfanyl]-4-chloranyl-pyridazin-3-one Openeye Name: 2-tert-butyl-5-[(4-tert-butylcyclohex-2-en-1-yl)methylsulfanyl]-4-chloro-pyridazin-3-one CAS Name: 2-tert-butyl-5-[(4-tert-butyl-1-cyclohex-2-enyl)methylthio]-4-chloro-3-pyridazinone IUPAC Name: 2-tert-butyl-5-[(4-tert-butylcyclohex-2-en-1-yl)methylsulfanyl]-4-chloropyridazin-3-one Traditional Name: 2-tert-butyl-5-[(4-tert-butylcyclohex-2-en-1-yl)methylthio]-4-chloro-pyridazin-3-one Formula: C19H29ClN2OS MolecularWeight: 368.96436

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC(C=C1)CSC2=C(C(=O)N(N=C2)C(C)(C)C)Cl

Isomeric SMILES

CC(C)(C)C1CCC(C=C1)CSC2=C(C(=O)N(N=C2)C(C)(C)C)Cl

InChI

InChI=1S/C19H29ClN2OS/c1-18(2,3)14-9-7-13(8-10-14)12-24-15-11-21-22(19(4,5)6)17(23)16(15)20/h7,9,11,13-14H,8,10,12H2,1-6H3