2-[(3-azanyl-4-oxidanyl-phenyl)methylsulfanyl]-6-propyl-1H-pyrimidin-4-one

Systemtic Name: 2-[(3-azanyl-4-oxidanyl-phenyl)methylsulfanyl]-6-propyl-1H-pyrimidin-4-one Openeye Name: 2-[(3-amino-4-hydroxy-phenyl)methylsulfanyl]-6-propyl-1H-pyrimidin-4-one CAS Name: 2-[(3-amino-4-hydroxyphenyl)methylthio]-6-propyl-1H-pyrimidin-4-one IUPAC Name: 2-[(3-amino-4-hydroxyphenyl)methylsulfanyl]-6-propyl-1H-pyrimidin-4-one Traditional Name: 2-[(3-amino-4-hydroxy-benzyl)thio]-6-propyl-1H-pyrimidin-4-one Formula: C14H17N3O2S MolecularWeight: 291.36868

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)N=C(N1)SCC2=CC(=C(C=C2)O)N

Isomeric SMILES

CCCC1=CC(=O)N=C(N1)SCC2=CC(=C(C=C2)O)N

InChI

InChI=1S/C14H17N3O2S/c1-2-3-10-7-13(19)17-14(16-10)20-8-9-4-5-12(18)11(15)6-9/h4-7,18H,2-3,8,15H2,1H3,(H,16,17,19)