[(2S)-1-[(6-ethoxycarbonyl-5-methyl-thieno[2,3-d]pyrimidin-4-yl)amino]propan-2-yl]-diethyl-azanium

Systemtic Name: [(2S)-1-[(6-ethoxycarbonyl-5-methyl-thieno[2,3-d]pyrimidin-4-yl)amino]propan-2-yl]-diethyl-azanium Openeye Name: [(1S)-2-[(6-ethoxycarbonyl-5-methyl-thieno[2,3-d]pyrimidin-4-yl)amino]-1-methyl-ethyl]-diethyl-ammonium CAS Name: [(2S)-1-[(6-ethoxycarbonyl-5-methyl-4-thieno[2,3-d]pyrimidinyl)amino]propan-2-yl]-diethylammonium IUPAC Name: [(2S)-1-[(6-ethoxycarbonyl-5-methylthieno[2,3-d]pyrimidin-4-yl)amino]propan-2-yl]-diethylazanium Traditional Name: [(1S)-2-[(6-carbethoxy-5-methyl-thieno[2,3-d]pyrimidin-4-yl)amino]-1-methyl-ethyl]-diethyl-ammonium Formula: C17H27N4O2S+ MolecularWeight: 351.48688

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)C(C)CNC1=C2C(=C(SC2=NC=N1)C(=O)OCC)C

Isomeric SMILES

CC[NH+](CC)[C@@H](C)CNC1=C2C(=C(SC2=NC=N1)C(=O)OCC)C

InChI

InChI=1S/C17H26N4O2S/c1-6-21(7-2)11(4)9-18-15-13-12(5)14(17(22)23-8-3)24-16(13)20-10-19-15/h10-11H,6-9H2,1-5H3,(H,18,19,20)/p+1/t11-/m0/s1