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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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