3-[2-(2-chlorophenyl)-4-methyl-6-morpholin-4-ylcarbonyl-thieno[2,3-d]pyrimidin-5-yl]oxypropyl-dimethyl-azanium

Systemtic Name: 3-[2-(2-chlorophenyl)-4-methyl-6-morpholin-4-ylcarbonyl-thieno[2,3-d]pyrimidin-5-yl]oxypropyl-dimethyl-azanium Openeye Name: 3-[2-(2-chlorophenyl)-4-methyl-6-(morpholine-4-carbonyl)thieno[2,3-d]pyrimidin-5-yl]oxypropyl-dimethyl-ammonium CAS Name: 3-[[2-(2-chlorophenyl)-4-methyl-6-[4-morpholinyl(oxo)methyl]-5-thieno[2,3-d]pyrimidinyl]oxy]propyl-dimethylammonium IUPAC Name: 3-[2-(2-chlorophenyl)-4-methyl-6-(morpholine-4-carbonyl)thieno[2,3-d]pyrimidin-5-yl]oxypropyl-dimethylazanium Traditional Name: 3-[2-(2-chlorophenyl)-4-methyl-6-(morpholine-4-carbonyl)thieno[2,3-d]pyrimidin-5-yl]oxypropyl-dimethyl-ammonium Formula: C23H28ClN4O3S+ MolecularWeight: 476.01142

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(SC2=NC(=N1)C3=CC=CC=C3Cl)C(=O)N4CCOCC4)OCCC[NH+](C)C

Isomeric SMILES

CC1=C2C(=C(SC2=NC(=N1)C3=CC=CC=C3Cl)C(=O)N4CCOCC4)OCCC[NH+](C)C

InChI

InChI=1S/C23H27ClN4O3S/c1-15-18-19(31-12-6-9-27(2)3)20(23(29)28-10-13-30-14-11-28)32-22(18)26-21(25-15)16-7-4-5-8-17(16)24/h4-5,7-8H,6,9-14H2,1-3H3/p+1