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

Systemtic Name: 6-[1-[2,6-bis(chloranyl)phenyl]ethyl]-2-cyclopentylsulfanyl-1H-pyrimidin-4-one Openeye Name: 2-cyclopentylsulfanyl-6-[1-(2,6-dichlorophenyl)ethyl]-1H-pyrimidin-4-one CAS Name: 2-(cyclopentylthio)-6-[1-(2,6-dichlorophenyl)ethyl]-1H-pyrimidin-4-one IUPAC Name: 2-cyclopentylsulfanyl-6-[1-(2,6-dichlorophenyl)ethyl]-1H-pyrimidin-4-one Traditional Name: 2-(cyclopentylthio)-6-[1-(2,6-dichlorophenyl)ethyl]-1H-pyrimidin-4-one Formula: C17H18Cl2N2OS MolecularWeight: 369.30862

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=O)N=C(N1)SC2CCCC2)C3=C(C=CC=C3Cl)Cl

Isomeric SMILES

CC(C1=CC(=O)N=C(N1)SC2CCCC2)C3=C(C=CC=C3Cl)Cl

InChI

InChI=1S/C17H18Cl2N2OS/c1-10(16-12(18)7-4-8-13(16)19)14-9-15(22)21-17(20-14)23-11-5-2-3-6-11/h4,7-11H,2-3,5-6H2,1H3,(H,20,21,22)