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

Systemtic Name: 3-[(2,5,6-trimethylthieno[2,3-d]pyrimidin-4-yl)amino]benzoate Openeye Name: 3-[(2,5,6-trimethylthieno[2,3-d]pyrimidin-4-yl)amino]benzoate CAS Name: 3-[(2,5,6-trimethyl-4-thieno[2,3-d]pyrimidinyl)amino]benzoate IUPAC Name: 3-[(2,5,6-trimethylthieno[2,3-d]pyrimidin-4-yl)amino]benzoate Traditional Name: 3-[(2,5,6-trimethylthieno[2,3-d]pyrimidin-4-yl)amino]benzoate Formula: C16H14N3O2S- MolecularWeight: 312.36626

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H15N3O2S/c1-8-9(2)22-15-13(8)14(17-10(3)18-15)19-12-6-4-5-11(7-12)16(20)21/h4-7H,1-3H3,(H,20,21)(H,17,18,19)/p-1