4-[ethyl(2-hydroxyethyl)amino]-5-methyl-2-phenyl-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: 4-[ethyl(2-hydroxyethyl)amino]-5-methyl-2-phenyl-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: 4-[ethyl(2-hydroxyethyl)amino]-5-methyl-2-phenyl-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 4-[ethyl(2-hydroxyethyl)amino]-5-methyl-2-phenyl-6-thieno[2,3-d]pyrimidinecarboxylate IUPAC Name: 4-[ethyl(2-hydroxyethyl)amino]-5-methyl-2-phenylthieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-[ethyl(2-hydroxyethyl)amino]-5-methyl-2-phenyl-thieno[2,3-d]pyrimidine-6-carboxylate Formula: C18H18N3O3S- MolecularWeight: 356.41882

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCO)C1=C2C(=C(SC2=NC(=N1)C3=CC=CC=C3)C(=O)[O-])C

Isomeric SMILES

CCN(CCO)C1=C2C(=C(SC2=NC(=N1)C3=CC=CC=C3)C(=O)[O-])C

InChI

InChI=1S/C18H19N3O3S/c1-3-21(9-10-22)16-13-11(2)14(18(23)24)25-17(13)20-15(19-16)12-7-5-4-6-8-12/h4-8,22H,3,9-10H2,1-2H3,(H,23,24)/p-1