2-[3-(2,5,6-trimethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl)propanoylamino]ethylazanium

Systemtic Name: 2-[3-(2,5,6-trimethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl)propanoylamino]ethylazanium Openeye Name: 2-[3-(2,5,6-trimethyl-4-oxo-thieno[2,3-d]pyrimidin-3-yl)propanoylamino]ethylammonium CAS Name: 2-[[1-oxo-3-(2,5,6-trimethyl-4-oxo-3-thieno[2,3-d]pyrimidinyl)propyl]amino]ethylammonium IUPAC Name: 2-[3-(2,5,6-trimethyl-4-oxothieno[2,3-d]pyrimidin-3-yl)propanoylamino]ethylazanium Traditional Name: 2-[3-(4-keto-2,5,6-trimethyl-thieno[2,3-d]pyrimidin-3-yl)propanoylamino]ethylammonium Formula: C14H21N4O2S+ MolecularWeight: 309.40714

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C(=N2)C)CCC(=O)NCC[NH3+])C

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C(=N2)C)CCC(=O)NCC[NH3+])C

InChI

InChI=1S/C14H20N4O2S/c1-8-9(2)21-13-12(8)14(20)18(10(3)17-13)7-4-11(19)16-6-5-15/h4-7,15H2,1-3H3,(H,16,19)/p+1