2-tert-butyl-4-chloranyl-5-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]pyridazin-3-one

Systemtic Name: 2-tert-butyl-4-chloranyl-5-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]pyridazin-3-one Openeye Name: 2-tert-butyl-4-chloro-5-[(3,5-dimethylisoxazol-4-yl)methylsulfanyl]pyridazin-3-one CAS Name: 2-tert-butyl-4-chloro-5-[(3,5-dimethyl-4-isoxazolyl)methylthio]-3-pyridazinone IUPAC Name: 2-tert-butyl-4-chloro-5-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]pyridazin-3-one Traditional Name: 2-tert-butyl-4-chloro-5-[(3,5-dimethylisoxazol-4-yl)methylthio]pyridazin-3-one Formula: C14H18ClN3O2S MolecularWeight: 327.82962

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)CSC2=C(C(=O)N(N=C2)C(C)(C)C)Cl

Isomeric SMILES

CC1=C(C(=NO1)C)CSC2=C(C(=O)N(N=C2)C(C)(C)C)Cl

InChI

InChI=1S/C14H18ClN3O2S/c1-8-10(9(2)20-17-8)7-21-11-6-16-18(14(3,4)5)13(19)12(11)15/h6H,7H2,1-5H3