(5,6-dimethyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidin-2-yl)methyl-(3-methoxypropyl)azanium

Systemtic Name: (5,6-dimethyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidin-2-yl)methyl-(3-methoxypropyl)azanium Openeye Name: (5,6-dimethyl-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl)methyl-(3-methoxypropyl)ammonium CAS Name: (5,6-dimethyl-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl)methyl-(3-methoxypropyl)ammonium IUPAC Name: (5,6-dimethyl-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl)methyl-(3-methoxypropyl)azanium Traditional Name: (4-keto-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-2-yl)methyl-(3-methoxypropyl)ammonium Formula: C13H20N3O2S+ MolecularWeight: 282.3818

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)NC(=N2)C[NH2+]CCCOC)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)NC(=N2)C[NH2+]CCCOC)C

InChI

InChI=1S/C13H19N3O2S/c1-8-9(2)19-13-11(8)12(17)15-10(16-13)7-14-5-4-6-18-3/h14H,4-7H2,1-3H3,(H,15,16,17)/p+1