N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-5-(4-methoxyphenyl)thieno[2,3-d]pyrimidin-4-amine

Systemtic Name: N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-5-(4-methoxyphenyl)thieno[2,3-d]pyrimidin-4-amine Openeye Name: N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-5-(4-methoxyphenyl)thieno[2,3-d]pyrimidin-4-amine CAS Name: N-[[(2S)-1-ethyl-2-pyrrolidin-1-iumyl]methyl]-5-(4-methoxyphenyl)-4-thieno[2,3-d]pyrimidinamine IUPAC Name: N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-5-(4-methoxyphenyl)thieno[2,3-d]pyrimidin-4-amine Traditional Name: [(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl-[5-(4-methoxyphenyl)thieno[2,3-d]pyrimidin-4-yl]amine Formula: C20H25N4OS+ MolecularWeight: 369.5037

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCCC1CNC2=C3C(=CSC3=NC=N2)C4=CC=C(C=C4)OC

Isomeric SMILES

CC[NH+]1CCC[C@H]1CNC2=C3C(=CSC3=NC=N2)C4=CC=C(C=C4)OC

InChI

InChI=1S/C20H24N4OS/c1-3-24-10-4-5-15(24)11-21-19-18-17(12-26-20(18)23-13-22-19)14-6-8-16(25-2)9-7-14/h6-9,12-13,15H,3-5,10-11H2,1-2H3,(H,21,22,23)/p+1/t15-/m0/s1