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

Systemtic Name: 2-[(2,3-dimethylpyridin-1-ium-1-yl)methyl]-5-thiophen-2-yl-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[(2,3-dimethylpyridin-1-ium-1-yl)methyl]-5-(2-thienyl)-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[(2,3-dimethyl-1-pyridin-1-iumyl)methyl]-5-thiophen-2-yl-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-[(2,3-dimethylpyridin-1-ium-1-yl)methyl]-5-thiophen-2-yl-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[(2,3-dimethylpyridin-1-ium-1-yl)methyl]-5-(2-thienyl)-3H-thieno[2,3-d]pyrimidin-4-one Formula: C18H16N3OS2+ MolecularWeight: 354.46914

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C([N+](=CC=C1)CC2=NC3=C(C(=CS3)C4=CC=CS4)C(=O)N2)C

Isomeric SMILES

CC1=C([N+](=CC=C1)CC2=NC3=C(C(=CS3)C4=CC=CS4)C(=O)N2)C

InChI

InChI=1S/C18H15N3OS2/c1-11-5-3-7-21(12(11)2)9-15-19-17(22)16-13(10-24-18(16)20-15)14-6-4-8-23-14/h3-8,10H,9H2,1-2H3/p+1