3-[(6-ethyl-2-methyl-thieno[2,3-d]pyrimidin-4-yl)amino]benzoate

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H15N3O2S/c1-3-12-8-13-14(17-9(2)18-15(13)22-12)19-11-6-4-5-10(7-11)16(20)21/h4-8H,3H2,1-2H3,(H,20,21)(H,17,18,19)/p-1