2-oxidanyl-4-[(2,5,6-trimethylthieno[2,3-d]pyrimidin-4-yl)amino]benzoate

Systemtic Name: 2-oxidanyl-4-[(2,5,6-trimethylthieno[2,3-d]pyrimidin-4-yl)amino]benzoate Openeye Name: 2-hydroxy-4-[(2,5,6-trimethylthieno[2,3-d]pyrimidin-4-yl)amino]benzoate CAS Name: 2-hydroxy-4-[(2,5,6-trimethyl-4-thieno[2,3-d]pyrimidinyl)amino]benzoate IUPAC Name: 2-hydroxy-4-[(2,5,6-trimethylthieno[2,3-d]pyrimidin-4-yl)amino]benzoate Traditional Name: 2-hydroxy-4-[(2,5,6-trimethylthieno[2,3-d]pyrimidin-4-yl)amino]benzoate Formula: C16H14N3O3S- MolecularWeight: 328.36566

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC(=NC(=C12)NC3=CC(=C(C=C3)C(=O)[O-])O)C)C

Isomeric SMILES

CC1=C(SC2=NC(=NC(=C12)NC3=CC(=C(C=C3)C(=O)[O-])O)C)C

InChI

InChI=1S/C16H15N3O3S/c1-7-8(2)23-15-13(7)14(17-9(3)18-15)19-10-4-5-11(16(21)22)12(20)6-10/h4-6,20H,1-3H3,(H,21,22)(H,17,18,19)/p-1