2,6-bis(azanyl)-5-(phenylmethylsulfanyl)-1H-pyrimidin-4-one

Systemtic Name: 2,6-bis(azanyl)-5-(phenylmethylsulfanyl)-1H-pyrimidin-4-one Openeye Name: 2,6-diamino-5-benzylsulfanyl-1H-pyrimidin-4-one CAS Name: 2,6-diamino-5-(phenylmethylthio)-1H-pyrimidin-4-one IUPAC Name: 2,6-diamino-5-benzylsulfanyl-1H-pyrimidin-4-one Traditional Name: 2,6-diamino-5-(benzylthio)-1H-pyrimidin-4-one Formula: C11H12N4OS MolecularWeight: 248.30418

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=C(NC(=NC2=O)N)N

Isomeric SMILES

C1=CC=C(C=C1)CSC2=C(NC(=NC2=O)N)N

InChI

InChI=1S/C11H12N4OS/c12-9-8(10(16)15-11(13)14-9)17-6-7-4-2-1-3-5-7/h1-5H,6H2,(H5,12,13,14,15,16)