6-[(E)-3-(2-hydroxyphenyl)-3-oxidanylidene-prop-1-enyl]-2-methylsulfanyl-1H-pteridin-4-one

Systemtic Name: 6-[(E)-3-(2-hydroxyphenyl)-3-oxidanylidene-prop-1-enyl]-2-methylsulfanyl-1H-pteridin-4-one Openeye Name: 6-[(E)-3-(2-hydroxyphenyl)-3-oxo-prop-1-enyl]-2-methylsulfanyl-1H-pteridin-4-one CAS Name: 6-[(E)-3-(2-hydroxyphenyl)-3-oxoprop-1-enyl]-2-(methylthio)-1H-pteridin-4-one IUPAC Name: 6-[(E)-3-(2-hydroxyphenyl)-3-oxoprop-1-enyl]-2-methylsulfanyl-1H-pteridin-4-one Traditional Name: 6-[(E)-3-(2-hydroxyphenyl)-3-keto-prop-1-enyl]-2-(methylthio)-1H-pteridin-4-one Formula: C16H12N4O3S MolecularWeight: 340.35648

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC(=O)C2=NC(=CN=C2N1)C=CC(=O)C3=CC=CC=C3O

Isomeric SMILES

CSC1=NC(=O)C2=NC(=CN=C2N1)/C=C/C(=O)C3=CC=CC=C3O

InChI

InChI=1S/C16H12N4O3S/c1-24-16-19-14-13(15(23)20-16)18-9(8-17-14)6-7-12(22)10-4-2-3-5-11(10)21/h2-8,21H,1H3,(H,17,19,20,23)/b7-6+