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

Systemtic Name: 3-[(6-ethylthieno[2,3-d]pyrimidin-4-yl)amino]benzoate Openeye Name: 3-[(6-ethylthieno[2,3-d]pyrimidin-4-yl)amino]benzoate CAS Name: 3-[(6-ethyl-4-thieno[2,3-d]pyrimidinyl)amino]benzoate IUPAC Name: 3-[(6-ethylthieno[2,3-d]pyrimidin-4-yl)amino]benzoate Traditional Name: 3-[(6-ethylthieno[2,3-d]pyrimidin-4-yl)amino]benzoate Formula: C15H12N3O2S- MolecularWeight: 298.33968

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(N=CN=C2S1)NC3=CC=CC(=C3)C(=O)[O-]

Isomeric SMILES

CCC1=CC2=C(N=CN=C2S1)NC3=CC=CC(=C3)C(=O)[O-]

InChI

InChI=1S/C15H13N3O2S/c1-2-11-7-12-13(16-8-17-14(12)21-11)18-10-5-3-4-9(6-10)15(19)20/h3-8H,2H2,1H3,(H,19,20)(H,16,17,18)/p-1