3-[(3-ethyl-1H-imidazol-3-ium-4-yl)methyl]-5-methyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3-[(3-ethyl-1H-imidazol-3-ium-4-yl)methyl]-5-methyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-[(3-ethyl-1H-imidazol-3-ium-4-yl)methyl]-5-methyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 3-[(3-ethyl-1H-imidazol-3-ium-4-yl)methyl]-5-methyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-[(3-ethyl-1H-imidazol-3-ium-4-yl)methyl]-5-methylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-[(3-ethyl-1H-imidazol-3-ium-4-yl)methyl]-5-methyl-thieno[2,3-d]pyrimidin-4-one Formula: C13H15N4OS+ MolecularWeight: 275.3494

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=CNC=C1CN2C=NC3=C(C2=O)C(=CS3)C

Isomeric SMILES

CC[N+]1=CNC=C1CN2C=NC3=C(C2=O)C(=CS3)C

InChI

InChI=1S/C13H14N4OS/c1-3-16-7-14-4-10(16)5-17-8-15-12-11(13(17)18)9(2)6-19-12/h4,6-8H,3,5H2,1-2H3/p+1