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

Systemtic Name: 2-[(4-chlorophenyl)methylsulfanyl]-4-oxidanyl-5-prop-2-enyl-1H-pyrimidin-6-one Openeye Name: 5-allyl-2-[(4-chlorophenyl)methylsulfanyl]-4-hydroxy-1H-pyrimidin-6-one CAS Name: 2-[(4-chlorophenyl)methylthio]-4-hydroxy-5-prop-2-enyl-1H-pyrimidin-6-one IUPAC Name: 2-[(4-chlorophenyl)methylsulfanyl]-4-hydroxy-5-prop-2-enyl-1H-pyrimidin-6-one Traditional Name: 5-allyl-2-[(4-chlorobenzyl)thio]-4-hydroxy-1H-pyrimidin-6-one Formula: C14H13ClN2O2S MolecularWeight: 308.78322

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC1=C(N=C(NC1=O)SCC2=CC=C(C=C2)Cl)O

Isomeric SMILES

C=CCC1=C(N=C(NC1=O)SCC2=CC=C(C=C2)Cl)O

InChI

InChI=1S/C14H13ClN2O2S/c1-2-3-11-12(18)16-14(17-13(11)19)20-8-9-4-6-10(15)7-5-9/h2,4-7H,1,3,8H2,(H2,16,17,18,19)