N-[[(2R)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-5,6-dimethyl-2-pyridin-3-yl-thieno[2,3-d]pyrimidin-4-amine

Systemtic Name: N-[[(2R)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-5,6-dimethyl-2-pyridin-3-yl-thieno[2,3-d]pyrimidin-4-amine Openeye Name: N-[[(2R)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-5,6-dimethyl-2-(3-pyridyl)thieno[2,3-d]pyrimidin-4-amine CAS Name: N-[[(2R)-1-ethyl-2-pyrrolidin-1-iumyl]methyl]-5,6-dimethyl-2-(3-pyridinyl)-4-thieno[2,3-d]pyrimidinamine IUPAC Name: N-[[(2R)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-5,6-dimethyl-2-pyridin-3-ylthieno[2,3-d]pyrimidin-4-amine Traditional Name: [5,6-dimethyl-2-(3-pyridyl)thieno[2,3-d]pyrimidin-4-yl]-[[(2R)-1-ethylpyrrolidin-1-ium-2-yl]methyl]amine Formula: C20H26N5S+ MolecularWeight: 368.51894

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCCC1CNC2=C3C(=C(SC3=NC(=N2)C4=CN=CC=C4)C)C

Isomeric SMILES

CC[NH+]1CCC[C@@H]1CNC2=C3C(=C(SC3=NC(=N2)C4=CN=CC=C4)C)C

InChI

InChI=1S/C20H25N5S/c1-4-25-10-6-8-16(25)12-22-19-17-13(2)14(3)26-20(17)24-18(23-19)15-7-5-9-21-11-15/h5,7,9,11,16H,4,6,8,10,12H2,1-3H3,(H,22,23,24)/p+1/t16-/m1/s1