2-[(4-chlorophenyl)methylsulfanyl]-5-(furan-2-ylmethyl)-1H-pyrimidin-6-one

Systemtic Name: 2-[(4-chlorophenyl)methylsulfanyl]-5-(furan-2-ylmethyl)-1H-pyrimidin-6-one Openeye Name: 2-[(4-chlorophenyl)methylsulfanyl]-5-(2-furylmethyl)-1H-pyrimidin-6-one CAS Name: 2-[(4-chlorophenyl)methylthio]-5-(2-furanylmethyl)-1H-pyrimidin-6-one IUPAC Name: 2-[(4-chlorophenyl)methylsulfanyl]-5-(furan-2-ylmethyl)-1H-pyrimidin-6-one Traditional Name: 2-[(4-chlorobenzyl)thio]-5-(2-furfuryl)-1H-pyrimidin-6-one Formula: C16H13ClN2O2S MolecularWeight: 332.80462

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)CC2=CN=C(NC2=O)SCC3=CC=C(C=C3)Cl

Isomeric SMILES

C1=COC(=C1)CC2=CN=C(NC2=O)SCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C16H13ClN2O2S/c17-13-5-3-11(4-6-13)10-22-16-18-9-12(15(20)19-16)8-14-2-1-7-21-14/h1-7,9H,8,10H2,(H,18,19,20)