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

Systemtic Name: 3-[[6-(diethylcarbamoyl)-5-methyl-thieno[2,3-d]pyrimidin-4-yl]amino]propyl-dimethyl-azanium Openeye Name: 3-[[6-(diethylcarbamoyl)-5-methyl-thieno[2,3-d]pyrimidin-4-yl]amino]propyl-dimethyl-ammonium CAS Name: 3-[[6-[diethylamino(oxo)methyl]-5-methyl-4-thieno[2,3-d]pyrimidinyl]amino]propyl-dimethylammonium IUPAC Name: 3-[[6-(diethylcarbamoyl)-5-methylthieno[2,3-d]pyrimidin-4-yl]amino]propyl-dimethylazanium Traditional Name: 3-[[6-(diethylcarbamoyl)-5-methyl-thieno[2,3-d]pyrimidin-4-yl]amino]propyl-dimethyl-ammonium Formula: C17H28N5OS+ MolecularWeight: 350.50212

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H27N5OS/c1-6-22(7-2)17(23)14-12(3)13-15(18-9-8-10-21(4)5)19-11-20-16(13)24-14/h11H,6-10H2,1-5H3,(H,18,19,20)/p+1