3-[2-(4-chlorophenyl)-4-methyl-6-pyrrolidin-1-ylcarbonyl-thieno[2,3-d]pyrimidin-5-yl]oxypropyl-dimethyl-azanium

Systemtic Name: 3-[2-(4-chlorophenyl)-4-methyl-6-pyrrolidin-1-ylcarbonyl-thieno[2,3-d]pyrimidin-5-yl]oxypropyl-dimethyl-azanium Openeye Name: 3-[2-(4-chlorophenyl)-4-methyl-6-(pyrrolidine-1-carbonyl)thieno[2,3-d]pyrimidin-5-yl]oxypropyl-dimethyl-ammonium CAS Name: 3-[[2-(4-chlorophenyl)-4-methyl-6-[oxo(1-pyrrolidinyl)methyl]-5-thieno[2,3-d]pyrimidinyl]oxy]propyl-dimethylammonium IUPAC Name: 3-[2-(4-chlorophenyl)-4-methyl-6-(pyrrolidine-1-carbonyl)thieno[2,3-d]pyrimidin-5-yl]oxypropyl-dimethylazanium Traditional Name: 3-[2-(4-chlorophenyl)-4-methyl-6-(pyrrolidine-1-carbonyl)thieno[2,3-d]pyrimidin-5-yl]oxypropyl-dimethyl-ammonium Formula: C23H28ClN4O2S+ MolecularWeight: 460.01202

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(SC2=NC(=N1)C3=CC=C(C=C3)Cl)C(=O)N4CCCC4)OCCC[NH+](C)C

Isomeric SMILES

CC1=C2C(=C(SC2=NC(=N1)C3=CC=C(C=C3)Cl)C(=O)N4CCCC4)OCCC[NH+](C)C

InChI

InChI=1S/C23H27ClN4O2S/c1-15-18-19(30-14-6-11-27(2)3)20(23(29)28-12-4-5-13-28)31-22(18)26-21(25-15)16-7-9-17(24)10-8-16/h7-10H,4-6,11-14H2,1-3H3/p+1