5,6-dimethyl-N-[[(2S)-4-(phenylmethyl)morpholin-4-ium-2-yl]methyl]thieno[2,3-d]pyrimidin-4-amine

Systemtic Name: 5,6-dimethyl-N-[[(2S)-4-(phenylmethyl)morpholin-4-ium-2-yl]methyl]thieno[2,3-d]pyrimidin-4-amine Openeye Name: N-[[(2S)-4-benzylmorpholin-4-ium-2-yl]methyl]-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-amine CAS Name: 5,6-dimethyl-N-[[(2S)-4-(phenylmethyl)-2-morpholin-4-iumyl]methyl]-4-thieno[2,3-d]pyrimidinamine IUPAC Name: N-[[(2S)-4-benzylmorpholin-4-ium-2-yl]methyl]-5,6-dimethylthieno[2,3-d]pyrimidin-4-amine Traditional Name: [(2S)-4-benzylmorpholin-4-ium-2-yl]methyl-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)amine Formula: C20H25N4OS+ MolecularWeight: 369.5037

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC=NC(=C12)NCC3C[NH+](CCO3)CC4=CC=CC=C4)C

Isomeric SMILES

CC1=C(SC2=NC=NC(=C12)NC[C@H]3C[NH+](CCO3)CC4=CC=CC=C4)C

InChI

InChI=1S/C20H24N4OS/c1-14-15(2)26-20-18(14)19(22-13-23-20)21-10-17-12-24(8-9-25-17)11-16-6-4-3-5-7-16/h3-7,13,17H,8-12H2,1-2H3,(H,21,22,23)/p+1/t17-/m0/s1