2-tert-butyl-4-chloranyl-5-[[4-(cyclopropylmethoxymethyl)cyclohexyl]methylsulfanyl]pyridazin-3-one

Systemtic Name: 2-tert-butyl-4-chloranyl-5-[[4-(cyclopropylmethoxymethyl)cyclohexyl]methylsulfanyl]pyridazin-3-one Openeye Name: 2-tert-butyl-4-chloro-5-[[4-(cyclopropylmethoxymethyl)cyclohexyl]methylsulfanyl]pyridazin-3-one CAS Name: 2-tert-butyl-4-chloro-5-[[4-(cyclopropylmethoxymethyl)cyclohexyl]methylthio]-3-pyridazinone IUPAC Name: 2-tert-butyl-4-chloro-5-[[4-(cyclopropylmethoxymethyl)cyclohexyl]methylsulfanyl]pyridazin-3-one Traditional Name: 2-tert-butyl-4-chloro-5-[[4-(cyclopropylmethoxymethyl)cyclohexyl]methylthio]pyridazin-3-one Formula: C20H31ClN2O2S MolecularWeight: 398.99034

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C(=O)C(=C(C=N1)SCC2CCC(CC2)COCC3CC3)Cl

Isomeric SMILES

CC(C)(C)N1C(=O)C(=C(C=N1)SCC2CCC(CC2)COCC3CC3)Cl

InChI

InChI=1S/C20H31ClN2O2S/c1-20(2,3)23-19(24)18(21)17(10-22-23)26-13-16-8-6-15(7-9-16)12-25-11-14-4-5-14/h10,14-16H,4-9,11-13H2,1-3H3