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

Systemtic Name: N-butyl-4-[(3-fluorophenyl)methylamino]-N,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: N-butyl-4-[(3-fluorophenyl)methylamino]-N,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: N-butyl-4-[(3-fluorophenyl)methylamino]-N,5-dimethyl-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: N-butyl-4-[(3-fluorophenyl)methylamino]-N,5-dimethylthieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: N-butyl-4-[(3-fluorobenzyl)amino]-N,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxamide Formula: C20H23FN4OS MolecularWeight: 386.486223

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C)C(=O)C1=C(C2=C(N=CN=C2S1)NCC3=CC(=CC=C3)F)C

Isomeric SMILES

CCCCN(C)C(=O)C1=C(C2=C(N=CN=C2S1)NCC3=CC(=CC=C3)F)C

InChI

InChI=1S/C20H23FN4OS/c1-4-5-9-25(3)20(26)17-13(2)16-18(23-12-24-19(16)27-17)22-11-14-7-6-8-15(21)10-14/h6-8,10,12H,4-5,9,11H2,1-3H3,(H,22,23,24)