5-azanyl-4-tert-butyl-2-methylsulfanyl-pyrrolo[2,3-d]pyrimidin-6-one

Systemtic Name: 5-azanyl-4-tert-butyl-2-methylsulfanyl-pyrrolo[2,3-d]pyrimidin-6-one Openeye Name: 5-amino-4-tert-butyl-2-methylsulfanyl-pyrrolo[2,3-d]pyrimidin-6-one CAS Name: 5-amino-4-tert-butyl-2-(methylthio)-6-pyrrolo[2,3-d]pyrimidinone IUPAC Name: 5-amino-4-tert-butyl-2-methylsulfanylpyrrolo[2,3-d]pyrimidin-6-one Traditional Name: 5-amino-4-tert-butyl-2-(methylthio)pyrrolo[2,3-d]pyrimidin-6-one Formula: C11H14N4OS MolecularWeight: 250.32006

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NC(=NC2=NC(=O)C(=C12)N)SC

Isomeric SMILES

CC(C)(C)C1=NC(=NC2=NC(=O)C(=C12)N)SC

InChI

InChI=1S/C11H14N4OS/c1-11(2,3)7-5-6(12)9(16)14-8(5)15-10(13-7)17-4/h1-4H3,(H2,12,13,14,15,16)