2-tert-butyl-4-chloranyl-5-(1H-1,2,4-triazol-5-ylsulfanyl)pyridazin-3-one

Systemtic Name: 2-tert-butyl-4-chloranyl-5-(1H-1,2,4-triazol-5-ylsulfanyl)pyridazin-3-one Openeye Name: 2-tert-butyl-4-chloro-5-(1H-1,2,4-triazol-5-ylsulfanyl)pyridazin-3-one CAS Name: 2-tert-butyl-4-chloro-5-(1H-1,2,4-triazol-5-ylthio)-3-pyridazinone IUPAC Name: 2-tert-butyl-4-chloro-5-(1H-1,2,4-triazol-5-ylsulfanyl)pyridazin-3-one Traditional Name: 2-tert-butyl-4-chloro-5-(1H-1,2,4-triazol-5-ylthio)pyridazin-3-one Formula: C10H12ClN5OS MolecularWeight: 285.75318

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C(=O)C(=C(C=N1)SC2=NC=NN2)Cl

Isomeric SMILES

CC(C)(C)N1C(=O)C(=C(C=N1)SC2=NC=NN2)Cl

InChI

InChI=1S/C10H12ClN5OS/c1-10(2,3)16-8(17)7(11)6(4-14-16)18-9-12-5-13-15-9/h4-5H,1-3H3,(H,12,13,15)