N-butyl-N-ethyl-3-[(2-fluorophenyl)methyl]-5-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidine-6-carboxamide

Systemtic Name: N-butyl-N-ethyl-3-[(2-fluorophenyl)methyl]-5-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: N-butyl-N-ethyl-3-[(2-fluorophenyl)methyl]-5-methyl-4-oxo-thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: N-butyl-N-ethyl-3-[(2-fluorophenyl)methyl]-5-methyl-4-oxo-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: N-butyl-N-ethyl-3-[(2-fluorophenyl)methyl]-5-methyl-4-oxothieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: N-butyl-N-ethyl-3-(2-fluorobenzyl)-4-keto-5-methyl-thieno[2,3-d]pyrimidine-6-carboxamide Formula: C21H24FN3O2S MolecularWeight: 401.497563

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC)C(=O)C1=C(C2=C(S1)N=CN(C2=O)CC3=CC=CC=C3F)C

Isomeric SMILES

CCCCN(CC)C(=O)C1=C(C2=C(S1)N=CN(C2=O)CC3=CC=CC=C3F)C

InChI

InChI=1S/C21H24FN3O2S/c1-4-6-11-24(5-2)21(27)18-14(3)17-19(28-18)23-13-25(20(17)26)12-15-9-7-8-10-16(15)22/h7-10,13H,4-6,11-12H2,1-3H3