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

Systemtic Name: N-butyl-3-[(2-fluorophenyl)methyl]-5-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: N-butyl-3-[(2-fluorophenyl)methyl]-5-methyl-4-oxo-thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: N-butyl-3-[(2-fluorophenyl)methyl]-5-methyl-4-oxo-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: N-butyl-3-[(2-fluorophenyl)methyl]-5-methyl-4-oxothieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: N-butyl-3-(2-fluorobenzyl)-4-keto-5-methyl-thieno[2,3-d]pyrimidine-6-carboxamide Formula: C19H20FN3O2S MolecularWeight: 373.444403

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20FN3O2S/c1-3-4-9-21-17(24)16-12(2)15-18(26-16)22-11-23(19(15)25)10-13-7-5-6-8-14(13)20/h5-8,11H,3-4,9-10H2,1-2H3,(H,21,24)