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

Systemtic Name: 3-[[5-methyl-6-(2-methylpropoxycarbonyl)thieno[2,3-d]pyrimidin-4-yl]amino]propylazanium Openeye Name: 3-[(6-isobutoxycarbonyl-5-methyl-thieno[2,3-d]pyrimidin-4-yl)amino]propylammonium CAS Name: 3-[[5-methyl-6-[2-methylpropoxy(oxo)methyl]-4-thieno[2,3-d]pyrimidinyl]amino]propylammonium IUPAC Name: 3-[[5-methyl-6-(2-methylpropoxycarbonyl)thieno[2,3-d]pyrimidin-4-yl]amino]propylazanium Traditional Name: 3-[(6-isobutoxycarbonyl-5-methyl-thieno[2,3-d]pyrimidin-4-yl)amino]propylammonium Formula: C15H23N4O2S+ MolecularWeight: 323.43372

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC=NC(=C12)NCCC[NH3+])C(=O)OCC(C)C

Isomeric SMILES

CC1=C(SC2=NC=NC(=C12)NCCC[NH3+])C(=O)OCC(C)C

InChI

InChI=1S/C15H22N4O2S/c1-9(2)7-21-15(20)12-10(3)11-13(17-6-4-5-16)18-8-19-14(11)22-12/h8-9H,4-7,16H2,1-3H3,(H,17,18,19)/p+1