[(2S)-butan-2-yl]-[(6-methoxycarbonyl-5-methyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidin-2-yl)methyl]azanium

Systemtic Name: [(2S)-butan-2-yl]-[(6-methoxycarbonyl-5-methyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidin-2-yl)methyl]azanium Openeye Name: (6-methoxycarbonyl-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl)methyl-[(1S)-1-methylpropyl]ammonium CAS Name: [(2S)-butan-2-yl]-[(6-methoxycarbonyl-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl)methyl]ammonium IUPAC Name: [(2S)-butan-2-yl]-[(6-methoxycarbonyl-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl)methyl]azanium Traditional Name: (6-carbomethoxy-4-keto-5-methyl-3H-thieno[2,3-d]pyrimidin-2-yl)methyl-[(1S)-1-methylpropyl]ammonium Formula: C14H20N3O3S+ MolecularWeight: 310.3919

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)[NH2+]CC1=NC2=C(C(=C(S2)C(=O)OC)C)C(=O)N1

Isomeric SMILES

CC[C@H](C)[NH2+]CC1=NC2=C(C(=C(S2)C(=O)OC)C)C(=O)N1

InChI

InChI=1S/C14H19N3O3S/c1-5-7(2)15-6-9-16-12(18)10-8(3)11(14(19)20-4)21-13(10)17-9/h7,15H,5-6H2,1-4H3,(H,16,17,18)/p+1/t7-/m0/s1