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

Systemtic Name: 2-[2-[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)amino]ethanoylamino]ethylazanium Openeye Name: 2-[[2-[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)amino]acetyl]amino]ethylammonium CAS Name: 2-[[2-[(5,6-dimethyl-4-thieno[2,3-d]pyrimidinyl)amino]-1-oxoethyl]amino]ethylammonium IUPAC Name: 2-[[2-[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)amino]acetyl]amino]ethylazanium Traditional Name: 2-[[2-[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)amino]acetyl]amino]ethylammonium Formula: C12H18N5OS+ MolecularWeight: 280.36922

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H17N5OS/c1-7-8(2)19-12-10(7)11(16-6-17-12)15-5-9(18)14-4-3-13/h6H,3-5,13H2,1-2H3,(H,14,18)(H,15,16,17)/p+1