N-(4-chloranyl-2-fluoranyl-phenyl)-4-(4-ethylpiperazin-1-yl)-5-methyl-thieno[2,3-d]pyrimidine-6-carboxamide

Systemtic Name: N-(4-chloranyl-2-fluoranyl-phenyl)-4-(4-ethylpiperazin-1-yl)-5-methyl-thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: N-(4-chloro-2-fluoro-phenyl)-4-(4-ethylpiperazin-1-yl)-5-methyl-thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: N-(4-chloro-2-fluorophenyl)-4-(4-ethyl-1-piperazinyl)-5-methyl-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: N-(4-chloro-2-fluorophenyl)-4-(4-ethylpiperazin-1-yl)-5-methylthieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: N-(4-chloro-2-fluoro-phenyl)-4-(4-ethylpiperazino)-5-methyl-thieno[2,3-d]pyrimidine-6-carboxamide Formula: C20H21ClFN5OS MolecularWeight: 433.930043

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=C3C(=C(SC3=NC=N2)C(=O)NC4=C(C=C(C=C4)Cl)F)C

Isomeric SMILES

CCN1CCN(CC1)C2=C3C(=C(SC3=NC=N2)C(=O)NC4=C(C=C(C=C4)Cl)F)C

InChI

InChI=1S/C20H21ClFN5OS/c1-3-26-6-8-27(9-7-26)18-16-12(2)17(29-20(16)24-11-23-18)19(28)25-15-5-4-13(21)10-14(15)22/h4-5,10-11H,3,6-9H2,1-2H3,(H,25,28)