2-(furan-2-ylmethyl)-5-(phenylmethylsulfanyl)-1H-pyrimidin-6-one

Systemtic Name: 2-(furan-2-ylmethyl)-5-(phenylmethylsulfanyl)-1H-pyrimidin-6-one Openeye Name: 5-benzylsulfanyl-2-(2-furylmethyl)-1H-pyrimidin-6-one CAS Name: 2-(2-furanylmethyl)-5-(phenylmethylthio)-1H-pyrimidin-6-one IUPAC Name: 5-benzylsulfanyl-2-(furan-2-ylmethyl)-1H-pyrimidin-6-one Traditional Name: 5-(benzylthio)-2-(2-furfuryl)-1H-pyrimidin-6-one Formula: C16H14N2O2S MolecularWeight: 298.35956

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=CN=C(NC2=O)CC3=CC=CO3

Isomeric SMILES

C1=CC=C(C=C1)CSC2=CN=C(NC2=O)CC3=CC=CO3

InChI

InChI=1S/C16H14N2O2S/c19-16-14(21-11-12-5-2-1-3-6-12)10-17-15(18-16)9-13-7-4-8-20-13/h1-8,10H,9,11H2,(H,17,18,19)