3-(3-methoxyphenyl)-5,6-dimethyl-4aH-thieno[2,3-d]pyrimidin-3-ium-4-one

Systemtic Name: 3-(3-methoxyphenyl)-5,6-dimethyl-4aH-thieno[2,3-d]pyrimidin-3-ium-4-one Openeye Name: 3-(3-methoxyphenyl)-5,6-dimethyl-4aH-thieno[2,3-d]pyrimidin-3-ium-4-one CAS Name: 3-(3-methoxyphenyl)-5,6-dimethyl-4aH-thieno[2,3-d]pyrimidin-3-ium-4-one IUPAC Name: 3-(3-methoxyphenyl)-5,6-dimethyl-4aH-thieno[2,3-d]pyrimidin-3-ium-4-one Traditional Name: 3-(3-methoxyphenyl)-5,6-dimethyl-4aH-thieno[2,3-d]pyrimidin-3-ium-4-one Formula: C15H15N2O2S+ MolecularWeight: 287.3568

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC=[N+](C(=O)C12)C3=CC(=CC=C3)OC)C

Isomeric SMILES

CC1=C(SC2=NC=[N+](C(=O)C12)C3=CC(=CC=C3)OC)C

InChI

InChI=1S/C15H15N2O2S/c1-9-10(2)20-14-13(9)15(18)17(8-16-14)11-5-4-6-12(7-11)19-3/h4-8,13H,1-3H3/q+1