(2R)-2-[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)azaniumyl]-3-oxidanyl-propanoate

Systemtic Name: (2R)-2-[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)azaniumyl]-3-oxidanyl-propanoate Openeye Name: (2R)-2-[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)ammonio]-3-hydroxy-propanoate CAS Name: (2R)-2-[(5,6-dimethyl-4-thieno[2,3-d]pyrimidinyl)ammonio]-3-hydroxypropanoate IUPAC Name: (2R)-2-[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)azaniumyl]-3-hydroxypropanoate Traditional Name: (2R)-2-[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)ammonio]-3-hydroxy-propionate Formula: C11H13N3O3S MolecularWeight: 267.30422

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC=NC(=C12)[NH2+]C(CO)C(=O)[O-])C

Isomeric SMILES

CC1=C(SC2=NC=NC(=C12)[NH2+][C@H](CO)C(=O)[O-])C

InChI

InChI=1S/C11H13N3O3S/c1-5-6(2)18-10-8(5)9(12-4-13-10)14-7(3-15)11(16)17/h4,7,15H,3H2,1-2H3,(H,16,17)(H,12,13,14)/t7-/m1/s1