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

Systemtic Name: N-(2-chloranyl-4-fluoranyl-phenyl)-5-methyl-4-(4-phenylpiperazin-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: N-(2-chloro-4-fluoro-phenyl)-5-methyl-4-(4-phenylpiperazin-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: N-(2-chloro-4-fluorophenyl)-5-methyl-4-(4-phenyl-1-piperazinyl)-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: N-(2-chloro-4-fluorophenyl)-5-methyl-4-(4-phenylpiperazin-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: N-(2-chloro-4-fluoro-phenyl)-5-methyl-4-(4-phenylpiperazino)thieno[2,3-d]pyrimidine-6-carboxamide Formula: C24H21ClFN5OS MolecularWeight: 481.972843

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC=NC(=C12)N3CCN(CC3)C4=CC=CC=C4)C(=O)NC5=C(C=C(C=C5)F)Cl

Isomeric SMILES

CC1=C(SC2=NC=NC(=C12)N3CCN(CC3)C4=CC=CC=C4)C(=O)NC5=C(C=C(C=C5)F)Cl

InChI

InChI=1S/C24H21ClFN5OS/c1-15-20-22(31-11-9-30(10-12-31)17-5-3-2-4-6-17)27-14-28-24(20)33-21(15)23(32)29-19-8-7-16(26)13-18(19)25/h2-8,13-14H,9-12H2,1H3,(H,29,32)