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

Systemtic Name: 3-[(6-ethoxycarbonyl-2,5-dimethyl-thieno[2,3-d]pyrimidin-4-yl)amino]propylazanium Openeye Name: 3-[(6-ethoxycarbonyl-2,5-dimethyl-thieno[2,3-d]pyrimidin-4-yl)amino]propylammonium CAS Name: 3-[(6-ethoxycarbonyl-2,5-dimethyl-4-thieno[2,3-d]pyrimidinyl)amino]propylammonium IUPAC Name: 3-[(6-ethoxycarbonyl-2,5-dimethylthieno[2,3-d]pyrimidin-4-yl)amino]propylazanium Traditional Name: 3-[(6-carbethoxy-2,5-dimethyl-thieno[2,3-d]pyrimidin-4-yl)amino]propylammonium Formula: C14H21N4O2S+ MolecularWeight: 309.40714

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(N=C(N=C2S1)C)NCCC[NH3+])C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(N=C(N=C2S1)C)NCCC[NH3+])C

InChI

InChI=1S/C14H20N4O2S/c1-4-20-14(19)11-8(2)10-12(16-7-5-6-15)17-9(3)18-13(10)21-11/h4-7,15H2,1-3H3,(H,16,17,18)/p+1