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

Systemtic Name: 6-azanyl-2-heptylsulfanyl-1H-pyrimidin-4-one Openeye Name: 6-amino-2-heptylsulfanyl-1H-pyrimidin-4-one CAS Name: 6-amino-2-(heptylthio)-1H-pyrimidin-4-one IUPAC Name: 6-amino-2-heptylsulfanyl-1H-pyrimidin-4-one Traditional Name: 6-amino-2-(heptylthio)-1H-pyrimidin-4-one Formula: C11H19N3OS MolecularWeight: 241.35306

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCSC1=NC(=O)C=C(N1)N

Isomeric SMILES

CCCCCCCSC1=NC(=O)C=C(N1)N

InChI

InChI=1S/C11H19N3OS/c1-2-3-4-5-6-7-16-11-13-9(12)8-10(15)14-11/h8H,2-7H2,1H3,(H3,12,13,14,15)