5-methyl-N-(3-morpholin-4-ium-4-ylpropyl)-6-phenyl-thieno[2,3-d]pyrimidin-4-amine

Systemtic Name: 5-methyl-N-(3-morpholin-4-ium-4-ylpropyl)-6-phenyl-thieno[2,3-d]pyrimidin-4-amine Openeye Name: 5-methyl-N-(3-morpholin-4-ium-4-ylpropyl)-6-phenyl-thieno[2,3-d]pyrimidin-4-amine CAS Name: 5-methyl-N-[3-(4-morpholin-4-iumyl)propyl]-6-phenyl-4-thieno[2,3-d]pyrimidinamine IUPAC Name: 5-methyl-N-(3-morpholin-4-ium-4-ylpropyl)-6-phenylthieno[2,3-d]pyrimidin-4-amine Traditional Name: (5-methyl-6-phenyl-thieno[2,3-d]pyrimidin-4-yl)-(3-morpholin-4-ium-4-ylpropyl)amine Formula: C20H25N4OS+ MolecularWeight: 369.5037

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC=NC(=C12)NCCC[NH+]3CCOCC3)C4=CC=CC=C4

Isomeric SMILES

CC1=C(SC2=NC=NC(=C12)NCCC[NH+]3CCOCC3)C4=CC=CC=C4

InChI

InChI=1S/C20H24N4OS/c1-15-17-19(21-8-5-9-24-10-12-25-13-11-24)22-14-23-20(17)26-18(15)16-6-3-2-4-7-16/h2-4,6-7,14H,5,8-13H2,1H3,(H,21,22,23)/p+1