2-[(4-oxidanylidene-6-propan-2-yl-3H-thieno[2,3-d]pyrimidin-2-yl)methylsulfanyl]ethylazanium

Systemtic Name: 2-[(4-oxidanylidene-6-propan-2-yl-3H-thieno[2,3-d]pyrimidin-2-yl)methylsulfanyl]ethylazanium Openeye Name: 2-[(6-isopropyl-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl)methylsulfanyl]ethylammonium CAS Name: 2-[(4-oxo-6-propan-2-yl-3H-thieno[2,3-d]pyrimidin-2-yl)methylthio]ethylammonium IUPAC Name: 2-[(4-oxo-6-propan-2-yl-3H-thieno[2,3-d]pyrimidin-2-yl)methylsulfanyl]ethylazanium Traditional Name: 2-[(6-isopropyl-4-keto-3H-thieno[2,3-d]pyrimidin-2-yl)methylthio]ethylammonium Formula: C12H18N3OS2+ MolecularWeight: 284.42082

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC2=C(S1)N=C(NC2=O)CSCC[NH3+]

Isomeric SMILES

CC(C)C1=CC2=C(S1)N=C(NC2=O)CSCC[NH3+]

InChI

InChI=1S/C12H17N3OS2/c1-7(2)9-5-8-11(16)14-10(6-17-4-3-13)15-12(8)18-9/h5,7H,3-4,6,13H2,1-2H3,(H,14,15,16)/p+1