ethyl 4-[2-(3-fluorophenyl)ethylamino]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: ethyl 4-[2-(3-fluorophenyl)ethylamino]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 4-[2-(3-fluorophenyl)ethylamino]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 4-[2-(3-fluorophenyl)ethylamino]-5-methyl-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-(3-fluorophenyl)ethylamino]-5-methylthieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-[2-(3-fluorophenyl)ethylamino]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C18H18FN3O2S MolecularWeight: 359.417823

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(N=CN=C2S1)NCCC3=CC(=CC=C3)F)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(N=CN=C2S1)NCCC3=CC(=CC=C3)F)C

InChI

InChI=1S/C18H18FN3O2S/c1-3-24-18(23)15-11(2)14-16(21-10-22-17(14)25-15)20-8-7-12-5-4-6-13(19)9-12/h4-6,9-10H,3,7-8H2,1-2H3,(H,20,21,22)