2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-1H-pteridin-4-one

Systemtic Name: 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-1H-pteridin-4-one Openeye Name: 2-[(3,5-dimethylisoxazol-4-yl)methylsulfanyl]-1H-pteridin-4-one CAS Name: 2-[(3,5-dimethyl-4-isoxazolyl)methylthio]-1H-pteridin-4-one IUPAC Name: 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-1H-pteridin-4-one Traditional Name: 2-[(3,5-dimethylisoxazol-4-yl)methylthio]-1H-pteridin-4-one Formula: C12H11N5O2S MolecularWeight: 289.31304

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)CSC2=NC(=O)C3=NC=CN=C3N2

Isomeric SMILES

CC1=C(C(=NO1)C)CSC2=NC(=O)C3=NC=CN=C3N2

InChI

InChI=1S/C12H11N5O2S/c1-6-8(7(2)19-17-6)5-20-12-15-10-9(11(18)16-12)13-3-4-14-10/h3-4H,5H2,1-2H3,(H,14,15,16,18)