(2S)-2-[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)amino]-2-phenyl-ethanoate

Systemtic Name: (2S)-2-[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)amino]-2-phenyl-ethanoate Openeye Name: (2S)-2-[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)amino]-2-phenyl-acetate CAS Name: (2S)-2-[(5,6-dimethyl-4-thieno[2,3-d]pyrimidinyl)amino]-2-phenylacetate IUPAC Name: (2S)-2-[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)amino]-2-phenylacetate Traditional Name: (2S)-2-[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)amino]-2-phenyl-acetate Formula: C16H14N3O2S- MolecularWeight: 312.36626

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC=NC(=C12)NC(C3=CC=CC=C3)C(=O)[O-])C

Isomeric SMILES

CC1=C(SC2=NC=NC(=C12)N[C@@H](C3=CC=CC=C3)C(=O)[O-])C

InChI

InChI=1S/C16H15N3O2S/c1-9-10(2)22-15-12(9)14(17-8-18-15)19-13(16(20)21)11-6-4-3-5-7-11/h3-8,13H,1-2H3,(H,20,21)(H,17,18,19)/p-1/t13-/m0/s1