N-(4-bromanyl-2-fluoranyl-phenyl)-2,5-dimethyl-4-piperidin-1-yl-thieno[2,3-d]pyrimidine-6-carboxamide

Systemtic Name: N-(4-bromanyl-2-fluoranyl-phenyl)-2,5-dimethyl-4-piperidin-1-yl-thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: N-(4-bromo-2-fluoro-phenyl)-2,5-dimethyl-4-(1-piperidyl)thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: N-(4-bromo-2-fluorophenyl)-2,5-dimethyl-4-(1-piperidinyl)-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: N-(4-bromo-2-fluorophenyl)-2,5-dimethyl-4-piperidin-1-ylthieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: N-(4-bromo-2-fluoro-phenyl)-2,5-dimethyl-4-piperidino-thieno[2,3-d]pyrimidine-6-carboxamide Formula: C20H20BrFN4OS MolecularWeight: 463.366403

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC(=NC(=C12)N3CCCCC3)C)C(=O)NC4=C(C=C(C=C4)Br)F

Isomeric SMILES

CC1=C(SC2=NC(=NC(=C12)N3CCCCC3)C)C(=O)NC4=C(C=C(C=C4)Br)F

InChI

InChI=1S/C20H20BrFN4OS/c1-11-16-18(26-8-4-3-5-9-26)23-12(2)24-20(16)28-17(11)19(27)25-15-7-6-13(21)10-14(15)22/h6-7,10H,3-5,8-9H2,1-2H3,(H,25,27)