(2S)-2-[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)azaniumyl]hexanoate

Systemtic Name: (2S)-2-[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)azaniumyl]hexanoate Openeye Name: (2S)-2-[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)ammonio]hexanoate CAS Name: (2S)-2-[(5,6-dimethyl-4-thieno[2,3-d]pyrimidinyl)ammonio]hexanoate IUPAC Name: (2S)-2-[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)azaniumyl]hexanoate Traditional Name: (2S)-2-[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)ammonio]hexanoate Formula: C14H19N3O2S MolecularWeight: 293.38456

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)[O-])[NH2+]C1=C2C(=C(SC2=NC=N1)C)C

Isomeric SMILES

CCCC[C@@H](C(=O)[O-])[NH2+]C1=C2C(=C(SC2=NC=N1)C)C

InChI

InChI=1S/C14H19N3O2S/c1-4-5-6-10(14(18)19)17-12-11-8(2)9(3)20-13(11)16-7-15-12/h7,10H,4-6H2,1-3H3,(H,18,19)(H,15,16,17)/t10-/m0/s1