6-(4-azanyl-1,3-thiazol-2-yl)-2-tert-butyl-4-chloranyl-5-(phenylmethylsulfanyl)pyridazin-3-one

Systemtic Name: 6-(4-azanyl-1,3-thiazol-2-yl)-2-tert-butyl-4-chloranyl-5-(phenylmethylsulfanyl)pyridazin-3-one Openeye Name: 6-(4-aminothiazol-2-yl)-5-benzylsulfanyl-2-tert-butyl-4-chloro-pyridazin-3-one CAS Name: 6-(4-amino-2-thiazolyl)-2-tert-butyl-4-chloro-5-(phenylmethylthio)-3-pyridazinone IUPAC Name: 6-(4-amino-1,3-thiazol-2-yl)-5-benzylsulfanyl-2-tert-butyl-4-chloropyridazin-3-one Traditional Name: 6-(4-aminothiazol-2-yl)-5-(benzylthio)-2-tert-butyl-4-chloro-pyridazin-3-one Formula: C18H19ClN4OS2 MolecularWeight: 406.95266

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C(=O)C(=C(C(=N1)C2=NC(=CS2)N)SCC3=CC=CC=C3)Cl

Isomeric SMILES

CC(C)(C)N1C(=O)C(=C(C(=N1)C2=NC(=CS2)N)SCC3=CC=CC=C3)Cl

InChI

InChI=1S/C18H19ClN4OS2/c1-18(2,3)23-17(24)13(19)15(25-9-11-7-5-4-6-8-11)14(22-23)16-21-12(20)10-26-16/h4-8,10H,9,20H2,1-3H3