[3-(2-hydroxyethyl)-5,6-dimethyl-3,4-dihydro-2H-thieno[2,3-d]pyrimidin-3-ium-1-yl]-phenyl-methanone

Systemtic Name: [3-(2-hydroxyethyl)-5,6-dimethyl-3,4-dihydro-2H-thieno[2,3-d]pyrimidin-3-ium-1-yl]-phenyl-methanone Openeye Name: [3-(2-hydroxyethyl)-5,6-dimethyl-3,4-dihydro-2H-thieno[2,3-d]pyrimidin-3-ium-1-yl]-phenyl-methanone CAS Name: [3-(2-hydroxyethyl)-5,6-dimethyl-3,4-dihydro-2H-thieno[2,3-d]pyrimidin-3-ium-1-yl]-phenylmethanone IUPAC Name: [3-(2-hydroxyethyl)-5,6-dimethyl-3,4-dihydro-2H-thieno[2,3-d]pyrimidin-3-ium-1-yl]-phenylmethanone Traditional Name: [3-(2-hydroxyethyl)-5,6-dimethyl-3,4-dihydro-2H-thieno[2,3-d]pyrimidin-3-ium-1-yl]-phenyl-methanone Formula: C17H21N2O2S+ MolecularWeight: 317.42584

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C[NH+](CN2C(=O)C3=CC=CC=C3)CCO)C

Isomeric SMILES

CC1=C(SC2=C1C[NH+](CN2C(=O)C3=CC=CC=C3)CCO)C

InChI

InChI=1S/C17H20N2O2S/c1-12-13(2)22-17-15(12)10-18(8-9-20)11-19(17)16(21)14-6-4-3-5-7-14/h3-7,20H,8-11H2,1-2H3/p+1