dimethyl 5-[(6-ethylthieno[2,3-d]pyrimidin-4-yl)amino]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[(6-ethylthieno[2,3-d]pyrimidin-4-yl)amino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[(6-ethylthieno[2,3-d]pyrimidin-4-yl)amino]benzene-1,3-dicarboxylate CAS Name: 5-[(6-ethyl-4-thieno[2,3-d]pyrimidinyl)amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[(6-ethylthieno[2,3-d]pyrimidin-4-yl)amino]benzene-1,3-dicarboxylate Traditional Name: 5-[(6-ethylthieno[2,3-d]pyrimidin-4-yl)amino]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C18H17N3O4S MolecularWeight: 371.41028

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(N=CN=C2S1)NC3=CC(=CC(=C3)C(=O)OC)C(=O)OC

Isomeric SMILES

CCC1=CC2=C(N=CN=C2S1)NC3=CC(=CC(=C3)C(=O)OC)C(=O)OC

InChI

InChI=1S/C18H17N3O4S/c1-4-13-8-14-15(19-9-20-16(14)26-13)21-12-6-10(17(22)24-2)5-11(7-12)18(23)25-3/h5-9H,4H2,1-3H3,(H,19,20,21)