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

Systemtic Name: 2-[[6-(butylcarbamoyl)-5-methyl-thieno[2,3-d]pyrimidin-4-yl]amino]ethyl-dimethyl-azanium Openeye Name: 2-[[6-(butylcarbamoyl)-5-methyl-thieno[2,3-d]pyrimidin-4-yl]amino]ethyl-dimethyl-ammonium CAS Name: 2-[[6-[butylamino(oxo)methyl]-5-methyl-4-thieno[2,3-d]pyrimidinyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[[6-(butylcarbamoyl)-5-methylthieno[2,3-d]pyrimidin-4-yl]amino]ethyl-dimethylazanium Traditional Name: 2-[[6-(butylcarbamoyl)-5-methyl-thieno[2,3-d]pyrimidin-4-yl]amino]ethyl-dimethyl-ammonium Formula: C16H26N5OS+ MolecularWeight: 336.47554

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=C(C2=C(N=CN=C2S1)NCC[NH+](C)C)C

Isomeric SMILES

CCCCNC(=O)C1=C(C2=C(N=CN=C2S1)NCC[NH+](C)C)C

InChI

InChI=1S/C16H25N5OS/c1-5-6-7-18-15(22)13-11(2)12-14(17-8-9-21(3)4)19-10-20-16(12)23-13/h10H,5-9H2,1-4H3,(H,18,22)(H,17,19,20)/p+1