5-phenyl-2-(sulfanylmethyl)-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5-phenyl-2-(sulfanylmethyl)-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 5-phenyl-2-(sulfanylmethyl)-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-(mercaptomethyl)-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 5-phenyl-2-(sulfanylmethyl)-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-(mercaptomethyl)-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one Formula: C13H10N2OS2 MolecularWeight: 274.3613

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H10N2OS2/c16-12-11-9(8-4-2-1-3-5-8)7-18-13(11)15-10(6-17)14-12/h1-5,7,17H,6H2,(H,14,15,16)