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

Systemtic Name: N-(3-fluoranyl-4-methyl-phenyl)-5-methyl-4-(4-methylpiperazin-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: N-(3-fluoro-4-methyl-phenyl)-5-methyl-4-(4-methylpiperazin-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: N-(3-fluoro-4-methylphenyl)-5-methyl-4-(4-methyl-1-piperazinyl)-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: N-(3-fluoro-4-methylphenyl)-5-methyl-4-(4-methylpiperazin-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: N-(3-fluoro-4-methyl-phenyl)-5-methyl-4-(4-methylpiperazino)thieno[2,3-d]pyrimidine-6-carboxamide Formula: C20H22FN5OS MolecularWeight: 399.484983

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=C(C3=C(N=CN=C3S2)N4CCN(CC4)C)C)F

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=C(C3=C(N=CN=C3S2)N4CCN(CC4)C)C)F

InChI

InChI=1S/C20H22FN5OS/c1-12-4-5-14(10-15(12)21)24-19(27)17-13(2)16-18(22-11-23-20(16)28-17)26-8-6-25(3)7-9-26/h4-5,10-11H,6-9H2,1-3H3,(H,24,27)