2-[(4-chlorophenyl)methylsulfanyl]-5-[(4-ethylphenyl)methyl]-4-oxidanyl-1H-pyrimidin-6-one

Systemtic Name: 2-[(4-chlorophenyl)methylsulfanyl]-5-[(4-ethylphenyl)methyl]-4-oxidanyl-1H-pyrimidin-6-one Openeye Name: 2-[(4-chlorophenyl)methylsulfanyl]-5-[(4-ethylphenyl)methyl]-4-hydroxy-1H-pyrimidin-6-one CAS Name: 2-[(4-chlorophenyl)methylthio]-5-[(4-ethylphenyl)methyl]-4-hydroxy-1H-pyrimidin-6-one IUPAC Name: 2-[(4-chlorophenyl)methylsulfanyl]-5-[(4-ethylphenyl)methyl]-4-hydroxy-1H-pyrimidin-6-one Traditional Name: 2-[(4-chlorobenzyl)thio]-5-(4-ethylbenzyl)-4-hydroxy-1H-pyrimidin-6-one Formula: C20H19ClN2O2S MolecularWeight: 386.89506

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CC2=C(N=C(NC2=O)SCC3=CC=C(C=C3)Cl)O

Isomeric SMILES

CCC1=CC=C(C=C1)CC2=C(N=C(NC2=O)SCC3=CC=C(C=C3)Cl)O

InChI

InChI=1S/C20H19ClN2O2S/c1-2-13-3-5-14(6-4-13)11-17-18(24)22-20(23-19(17)25)26-12-15-7-9-16(21)10-8-15/h3-10H,2,11-12H2,1H3,(H2,22,23,24,25)