2-[2-(4-oxidanylidenethieno[2,3-d]pyrimidin-3-yl)ethanoylamino]ethyl-di(propan-2-yl)azanium

Systemtic Name: 2-[2-(4-oxidanylidenethieno[2,3-d]pyrimidin-3-yl)ethanoylamino]ethyl-di(propan-2-yl)azanium Openeye Name: diisopropyl-[2-[[2-(4-oxothieno[2,3-d]pyrimidin-3-yl)acetyl]amino]ethyl]ammonium CAS Name: 2-[[1-oxo-2-(4-oxo-3-thieno[2,3-d]pyrimidinyl)ethyl]amino]ethyl-di(propan-2-yl)ammonium IUPAC Name: 2-[[2-(4-oxothieno[2,3-d]pyrimidin-3-yl)acetyl]amino]ethyl-di(propan-2-yl)azanium Traditional Name: diisopropyl-[2-[[2-(4-ketothieno[2,3-d]pyrimidin-3-yl)acetyl]amino]ethyl]ammonium Formula: C16H25N4O2S+ MolecularWeight: 337.4603

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+](CCNC(=O)CN1C=NC2=C(C1=O)C=CS2)C(C)C

Isomeric SMILES

CC(C)[NH+](CCNC(=O)CN1C=NC2=C(C1=O)C=CS2)C(C)C

InChI

InChI=1S/C16H24N4O2S/c1-11(2)20(12(3)4)7-6-17-14(21)9-19-10-18-15-13(16(19)22)5-8-23-15/h5,8,10-12H,6-7,9H2,1-4H3,(H,17,21)/p+1