2-[3-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanylpropanoylamino]ethylazanium

Systemtic Name: 2-[3-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanylpropanoylamino]ethylazanium Openeye Name: 2-[3-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanylpropanoylamino]ethylammonium CAS Name: 2-[[3-[(5,6-dimethyl-4-thieno[2,3-d]pyrimidinyl)thio]-1-oxopropyl]amino]ethylammonium IUPAC Name: 2-[3-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanylpropanoylamino]ethylazanium Traditional Name: 2-[3-[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)thio]propanoylamino]ethylammonium Formula: C13H19N4OS2+ MolecularWeight: 311.44616

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=NC=N2)SCCC(=O)NCC[NH3+])C

Isomeric SMILES

CC1=C(SC2=C1C(=NC=N2)SCCC(=O)NCC[NH3+])C

InChI

InChI=1S/C13H18N4OS2/c1-8-9(2)20-13-11(8)12(16-7-17-13)19-6-3-10(18)15-5-4-14/h7H,3-6,14H2,1-2H3,(H,15,18)/p+1