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

Systemtic Name: 2-[4-[(6-ethyl-2-methyl-thieno[2,3-d]pyrimidin-4-yl)amino]phenyl]ethanoate Openeye Name: 2-[4-[(6-ethyl-2-methyl-thieno[2,3-d]pyrimidin-4-yl)amino]phenyl]acetate CAS Name: 2-[4-[(6-ethyl-2-methyl-4-thieno[2,3-d]pyrimidinyl)amino]phenyl]acetate IUPAC Name: 2-[4-[(6-ethyl-2-methylthieno[2,3-d]pyrimidin-4-yl)amino]phenyl]acetate Traditional Name: 2-[4-[(6-ethyl-2-methyl-thieno[2,3-d]pyrimidin-4-yl)amino]phenyl]acetate Formula: C17H16N3O2S- MolecularWeight: 326.39284

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17N3O2S/c1-3-13-9-14-16(18-10(2)19-17(14)23-13)20-12-6-4-11(5-7-12)8-15(21)22/h4-7,9H,3,8H2,1-2H3,(H,21,22)(H,18,19,20)/p-1