N-(3-imidazol-1-ylpropyl)-5,6-dimethyl-2-(morpholin-4-ium-4-ylmethyl)thieno[2,3-d]pyrimidin-4-amine

Systemtic Name: N-(3-imidazol-1-ylpropyl)-5,6-dimethyl-2-(morpholin-4-ium-4-ylmethyl)thieno[2,3-d]pyrimidin-4-amine Openeye Name: N-(3-imidazol-1-ylpropyl)-5,6-dimethyl-2-(morpholin-4-ium-4-ylmethyl)thieno[2,3-d]pyrimidin-4-amine CAS Name: N-[3-(1-imidazolyl)propyl]-5,6-dimethyl-2-(4-morpholin-4-iumylmethyl)-4-thieno[2,3-d]pyrimidinamine IUPAC Name: N-(3-imidazol-1-ylpropyl)-5,6-dimethyl-2-(morpholin-4-ium-4-ylmethyl)thieno[2,3-d]pyrimidin-4-amine Traditional Name: [5,6-dimethyl-2-(morpholin-4-ium-4-ylmethyl)thieno[2,3-d]pyrimidin-4-yl]-(3-imidazol-1-ylpropyl)amine Formula: C19H27N6OS+ MolecularWeight: 387.52228

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC(=NC(=C12)NCCCN3C=CN=C3)C[NH+]4CCOCC4)C

Isomeric SMILES

CC1=C(SC2=NC(=NC(=C12)NCCCN3C=CN=C3)C[NH+]4CCOCC4)C

InChI

InChI=1S/C19H26N6OS/c1-14-15(2)27-19-17(14)18(21-4-3-6-25-7-5-20-13-25)22-16(23-19)12-24-8-10-26-11-9-24/h5,7,13H,3-4,6,8-12H2,1-2H3,(H,21,22,23)/p+1