7-phenyl-2-sulfanylidene-1H-pteridin-4-one

Systemtic Name: 7-phenyl-2-sulfanylidene-1H-pteridin-4-one Openeye Name: 7-phenyl-2-thioxo-1H-pteridin-4-one CAS Name: 7-phenyl-2-sulfanylidene-1H-pteridin-4-one IUPAC Name: 7-phenyl-2-sulfanylidene-1H-pteridin-4-one Traditional Name: 7-phenyl-2-thioxo-1H-pteridin-4-one Formula: C12H8N4OS MolecularWeight: 256.28312

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CN=C3C(=N2)NC(=S)NC3=O

Isomeric SMILES

C1=CC=C(C=C1)C2=CN=C3C(=N2)NC(=S)NC3=O

InChI

InChI=1S/C12H8N4OS/c17-11-9-10(15-12(18)16-11)14-8(6-13-9)7-4-2-1-3-5-7/h1-6H,(H2,14,15,16,17,18)