2-tert-butyl-4-chloranyl-5-[(2,2-dimethylchromen-6-yl)methylsulfanyl]pyridazin-3-one

Systemtic Name: 2-tert-butyl-4-chloranyl-5-[(2,2-dimethylchromen-6-yl)methylsulfanyl]pyridazin-3-one Openeye Name: 2-tert-butyl-4-chloro-5-[(2,2-dimethylchromen-6-yl)methylsulfanyl]pyridazin-3-one CAS Name: 2-tert-butyl-4-chloro-5-[(2,2-dimethyl-1-benzopyran-6-yl)methylthio]-3-pyridazinone IUPAC Name: 2-tert-butyl-4-chloro-5-[(2,2-dimethylchromen-6-yl)methylsulfanyl]pyridazin-3-one Traditional Name: 2-tert-butyl-4-chloro-5-[(2,2-dimethylchromen-6-yl)methylthio]pyridazin-3-one Formula: C20H23ClN2O2S MolecularWeight: 390.92682

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C=CC2=C(O1)C=CC(=C2)CSC3=C(C(=O)N(N=C3)C(C)(C)C)Cl)C

Isomeric SMILES

CC1(C=CC2=C(O1)C=CC(=C2)CSC3=C(C(=O)N(N=C3)C(C)(C)C)Cl)C

InChI

InChI=1S/C20H23ClN2O2S/c1-19(2,3)23-18(24)17(21)16(11-22-23)26-12-13-6-7-15-14(10-13)8-9-20(4,5)25-15/h6-11H,12H2,1-5H3