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

Systemtic Name: 3-[(6-ethoxycarbonyl-5-methyl-thieno[2,3-d]pyrimidin-4-yl)amino]propyl-diethyl-azanium Openeye Name: 3-[(6-ethoxycarbonyl-5-methyl-thieno[2,3-d]pyrimidin-4-yl)amino]propyl-diethyl-ammonium CAS Name: 3-[(6-ethoxycarbonyl-5-methyl-4-thieno[2,3-d]pyrimidinyl)amino]propyl-diethylammonium IUPAC Name: 3-[(6-ethoxycarbonyl-5-methylthieno[2,3-d]pyrimidin-4-yl)amino]propyl-diethylazanium Traditional Name: 3-[(6-carbethoxy-5-methyl-thieno[2,3-d]pyrimidin-4-yl)amino]propyl-diethyl-ammonium Formula: C17H27N4O2S+ MolecularWeight: 351.48688

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCCNC1=C2C(=C(SC2=NC=N1)C(=O)OCC)C

Isomeric SMILES

CC[NH+](CC)CCCNC1=C2C(=C(SC2=NC=N1)C(=O)OCC)C

InChI

InChI=1S/C17H26N4O2S/c1-5-21(6-2)10-8-9-18-15-13-12(4)14(17(22)23-7-3)24-16(13)20-11-19-15/h11H,5-10H2,1-4H3,(H,18,19,20)/p+1