2-(hydroxymethyl)-5-(4-methylphenyl)-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-(hydroxymethyl)-5-(4-methylphenyl)-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-(hydroxymethyl)-5-(p-tolyl)-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-(hydroxymethyl)-5-(4-methylphenyl)-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-(hydroxymethyl)-5-(4-methylphenyl)-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-methylol-5-(p-tolyl)-3H-thieno[2,3-d]pyrimidin-4-one Formula: C14H12N2O2S MolecularWeight: 272.32228

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CSC3=C2C(=O)NC(=N3)CO

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC3=C2C(=O)NC(=N3)CO

InChI

InChI=1S/C14H12N2O2S/c1-8-2-4-9(5-3-8)10-7-19-14-12(10)13(18)15-11(6-17)16-14/h2-5,7,17H,6H2,1H3,(H,15,16,18)