(2R)-2-[(6-ethyl-2-methyl-thieno[2,3-d]pyrimidin-4-yl)azaniumyl]-3-methyl-butanoate

Systemtic Name: (2R)-2-[(6-ethyl-2-methyl-thieno[2,3-d]pyrimidin-4-yl)azaniumyl]-3-methyl-butanoate Openeye Name: (2R)-2-[(6-ethyl-2-methyl-thieno[2,3-d]pyrimidin-4-yl)ammonio]-3-methyl-butanoate CAS Name: (2R)-2-[(6-ethyl-2-methyl-4-thieno[2,3-d]pyrimidinyl)ammonio]-3-methylbutanoate IUPAC Name: (2R)-2-[(6-ethyl-2-methylthieno[2,3-d]pyrimidin-4-yl)azaniumyl]-3-methylbutanoate Traditional Name: (2R)-2-[(6-ethyl-2-methyl-thieno[2,3-d]pyrimidin-4-yl)ammonio]-3-methyl-butyrate Formula: C14H19N3O2S MolecularWeight: 293.38456

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(N=C(N=C2S1)C)[NH2+]C(C(C)C)C(=O)[O-]

Isomeric SMILES

CCC1=CC2=C(N=C(N=C2S1)C)[NH2+][C@H](C(C)C)C(=O)[O-]

InChI

InChI=1S/C14H19N3O2S/c1-5-9-6-10-12(15-8(4)16-13(10)20-9)17-11(7(2)3)14(18)19/h6-7,11H,5H2,1-4H3,(H,18,19)(H,15,16,17)/t11-/m1/s1