2-[(1R)-1-piperidin-1-ium-1-ylethyl]-5-thiophen-2-yl-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[(1R)-1-piperidin-1-ium-1-ylethyl]-5-thiophen-2-yl-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[(1R)-1-piperidin-1-ium-1-ylethyl]-5-(2-thienyl)-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[(1R)-1-(1-piperidin-1-iumyl)ethyl]-5-thiophen-2-yl-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-[(1R)-1-piperidin-1-ium-1-ylethyl]-5-thiophen-2-yl-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[(1R)-1-piperidin-1-ium-1-ylethyl]-5-(2-thienyl)-3H-thieno[2,3-d]pyrimidin-4-one Formula: C17H20N3OS2+ MolecularWeight: 346.4902

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC2=C(C(=CS2)C3=CC=CS3)C(=O)N1)[NH+]4CCCCC4

Isomeric SMILES

C[C@H](C1=NC2=C(C(=CS2)C3=CC=CS3)C(=O)N1)[NH+]4CCCCC4

InChI

InChI=1S/C17H19N3OS2/c1-11(20-7-3-2-4-8-20)15-18-16(21)14-12(10-23-17(14)19-15)13-6-5-9-22-13/h5-6,9-11H,2-4,7-8H2,1H3,(H,18,19,21)/p+1/t11-/m1/s1