6-azanyl-2-nonylsulfanyl-1H-pyrimidin-4-one

Systemtic Name: 6-azanyl-2-nonylsulfanyl-1H-pyrimidin-4-one Openeye Name: 6-amino-2-nonylsulfanyl-1H-pyrimidin-4-one CAS Name: 6-amino-2-(nonylthio)-1H-pyrimidin-4-one IUPAC Name: 6-amino-2-nonylsulfanyl-1H-pyrimidin-4-one Traditional Name: 6-amino-2-(nonylthio)-1H-pyrimidin-4-one Formula: C13H23N3OS MolecularWeight: 269.40622

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCSC1=NC(=O)C=C(N1)N

Isomeric SMILES

CCCCCCCCCSC1=NC(=O)C=C(N1)N

InChI

InChI=1S/C13H23N3OS/c1-2-3-4-5-6-7-8-9-18-13-15-11(14)10-12(17)16-13/h10H,2-9H2,1H3,(H3,14,15,16,17)