5-[(E)-but-1-enyl]sulfanyl-2-tert-butyl-4-chloranyl-pyridazin-3-one

Systemtic Name: 5-[(E)-but-1-enyl]sulfanyl-2-tert-butyl-4-chloranyl-pyridazin-3-one Openeye Name: 5-[(E)-but-1-enyl]sulfanyl-2-tert-butyl-4-chloro-pyridazin-3-one CAS Name: 5-[[(E)-but-1-enyl]thio]-2-tert-butyl-4-chloro-3-pyridazinone IUPAC Name: 5-[(E)-but-1-enyl]sulfanyl-2-tert-butyl-4-chloropyridazin-3-one Traditional Name: 5-[[(E)-but-1-enyl]thio]-2-tert-butyl-4-chloro-pyridazin-3-one Formula: C12H17ClN2OS MolecularWeight: 272.79418

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Descriptors Computed from Structure

Canonical SMILES:

CCC=CSC1=C(C(=O)N(N=C1)C(C)(C)C)Cl

Isomeric SMILES

CC/C=C/SC1=C(C(=O)N(N=C1)C(C)(C)C)Cl

InChI

InChI=1S/C12H17ClN2OS/c1-5-6-7-17-9-8-14-15(12(2,3)4)11(16)10(9)13/h6-8H,5H2,1-4H3/b7-6+