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

Systemtic Name: ethyl 4-azanyl-2-[[(3-fluorophenyl)methyl-methyl-amino]methyl]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 4-amino-2-[[(3-fluorophenyl)methyl-methyl-amino]methyl]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 4-amino-2-[[(3-fluorophenyl)methyl-methylamino]methyl]-5-methyl-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-amino-2-[[(3-fluorophenyl)methyl-methylamino]methyl]-5-methylthieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-amino-2-[[(3-fluorobenzyl)-methyl-amino]methyl]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C19H21FN4O2S MolecularWeight: 388.459043

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(N=C(N=C2S1)CN(C)CC3=CC(=CC=C3)F)N)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(N=C(N=C2S1)CN(C)CC3=CC(=CC=C3)F)N)C

InChI

InChI=1S/C19H21FN4O2S/c1-4-26-19(25)16-11(2)15-17(21)22-14(23-18(15)27-16)10-24(3)9-12-6-5-7-13(20)8-12/h5-8H,4,9-10H2,1-3H3,(H2,21,22,23)