3-[(6-ethoxycarbonyl-5-methyl-thieno[2,3-d]pyrimidin-4-yl)amino]propyl-dimethyl-azanium

Systemtic Name: 3-[(6-ethoxycarbonyl-5-methyl-thieno[2,3-d]pyrimidin-4-yl)amino]propyl-dimethyl-azanium Openeye Name: 3-[(6-ethoxycarbonyl-5-methyl-thieno[2,3-d]pyrimidin-4-yl)amino]propyl-dimethyl-ammonium CAS Name: 3-[(6-ethoxycarbonyl-5-methyl-4-thieno[2,3-d]pyrimidinyl)amino]propyl-dimethylammonium IUPAC Name: 3-[(6-ethoxycarbonyl-5-methylthieno[2,3-d]pyrimidin-4-yl)amino]propyl-dimethylazanium Traditional Name: 3-[(6-carbethoxy-5-methyl-thieno[2,3-d]pyrimidin-4-yl)amino]propyl-dimethyl-ammonium Formula: C15H23N4O2S+ MolecularWeight: 323.43372

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(N=CN=C2S1)NCCC[NH+](C)C)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(N=CN=C2S1)NCCC[NH+](C)C)C

InChI

InChI=1S/C15H22N4O2S/c1-5-21-15(20)12-10(2)11-13(16-7-6-8-19(3)4)17-9-18-14(11)22-12/h9H,5-8H2,1-4H3,(H,16,17,18)/p+1