6-[1-[2,6-bis(chloranyl)phenyl]ethyl]-2-cyclohexylsulfanyl-1H-pyrimidin-4-one

Systemtic Name: 6-[1-[2,6-bis(chloranyl)phenyl]ethyl]-2-cyclohexylsulfanyl-1H-pyrimidin-4-one Openeye Name: 2-cyclohexylsulfanyl-6-[1-(2,6-dichlorophenyl)ethyl]-1H-pyrimidin-4-one CAS Name: 2-(cyclohexylthio)-6-[1-(2,6-dichlorophenyl)ethyl]-1H-pyrimidin-4-one IUPAC Name: 2-cyclohexylsulfanyl-6-[1-(2,6-dichlorophenyl)ethyl]-1H-pyrimidin-4-one Traditional Name: 2-(cyclohexylthio)-6-[1-(2,6-dichlorophenyl)ethyl]-1H-pyrimidin-4-one Formula: C18H20Cl2N2OS MolecularWeight: 383.3352

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=O)N=C(N1)SC2CCCCC2)C3=C(C=CC=C3Cl)Cl

Isomeric SMILES

CC(C1=CC(=O)N=C(N1)SC2CCCCC2)C3=C(C=CC=C3Cl)Cl

InChI

InChI=1S/C18H20Cl2N2OS/c1-11(17-13(19)8-5-9-14(17)20)15-10-16(23)22-18(21-15)24-12-6-3-2-4-7-12/h5,8-12H,2-4,6-7H2,1H3,(H,21,22,23)