3-[[1-(2-hydroxyethyl)piperidin-1-ium-4-yl]methyl]thieno[3,2-d]pyrimidin-4-one

Systemtic Name: 3-[[1-(2-hydroxyethyl)piperidin-1-ium-4-yl]methyl]thieno[3,2-d]pyrimidin-4-one Openeye Name: 3-[[1-(2-hydroxyethyl)piperidin-1-ium-4-yl]methyl]thieno[3,2-d]pyrimidin-4-one CAS Name: 3-[[1-(2-hydroxyethyl)-4-piperidin-1-iumyl]methyl]-4-thieno[3,2-d]pyrimidinone IUPAC Name: 3-[[1-(2-hydroxyethyl)piperidin-1-ium-4-yl]methyl]thieno[3,2-d]pyrimidin-4-one Traditional Name: 3-[[1-(2-hydroxyethyl)piperidin-1-ium-4-yl]methyl]thieno[3,2-d]pyrimidin-4-one Formula: C14H20N3O2S+ MolecularWeight: 294.3925

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1CN2C=NC3=C(C2=O)SC=C3)CCO

Isomeric SMILES

C1C[NH+](CCC1CN2C=NC3=C(C2=O)SC=C3)CCO

InChI

InChI=1S/C14H19N3O2S/c18-7-6-16-4-1-11(2-5-16)9-17-10-15-12-3-8-20-13(12)14(17)19/h3,8,10-11,18H,1-2,4-7,9H2/p+1