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

Systemtic Name: 3-[(3-fluorophenyl)methyl]-5-methyl-N-octyl-4-oxidanylidene-thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: 3-[(3-fluorophenyl)methyl]-5-methyl-N-octyl-4-oxo-thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: 3-[(3-fluorophenyl)methyl]-5-methyl-N-octyl-4-oxo-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: 3-[(3-fluorophenyl)methyl]-5-methyl-N-octyl-4-oxothieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: 3-(3-fluorobenzyl)-4-keto-5-methyl-N-octyl-thieno[2,3-d]pyrimidine-6-carboxamide Formula: C23H28FN3O2S MolecularWeight: 429.550723

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCNC(=O)C1=C(C2=C(S1)N=CN(C2=O)CC3=CC(=CC=C3)F)C

Isomeric SMILES

CCCCCCCCNC(=O)C1=C(C2=C(S1)N=CN(C2=O)CC3=CC(=CC=C3)F)C

InChI

InChI=1S/C23H28FN3O2S/c1-3-4-5-6-7-8-12-25-21(28)20-16(2)19-22(30-20)26-15-27(23(19)29)14-17-10-9-11-18(24)13-17/h9-11,13,15H,3-8,12,14H2,1-2H3,(H,25,28)