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

Systemtic Name: N-(3-chloranyl-4-methyl-phenyl)-5-methyl-4-(4-pyridin-2-ylpiperazin-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: N-(3-chloro-4-methyl-phenyl)-5-methyl-4-[4-(2-pyridyl)piperazin-1-yl]thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: N-(3-chloro-4-methylphenyl)-5-methyl-4-[4-(2-pyridinyl)-1-piperazinyl]-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: N-(3-chloro-4-methylphenyl)-5-methyl-4-(4-pyridin-2-ylpiperazin-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: N-(3-chloro-4-methyl-phenyl)-5-methyl-4-[4-(2-pyridyl)piperazino]thieno[2,3-d]pyrimidine-6-carboxamide Formula: C24H23ClN6OS MolecularWeight: 478.99702

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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)C5=CC=CC=N5)C)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=C(C3=C(N=CN=C3S2)N4CCN(CC4)C5=CC=CC=N5)C)Cl

InChI

InChI=1S/C24H23ClN6OS/c1-15-6-7-17(13-18(15)25)29-23(32)21-16(2)20-22(27-14-28-24(20)33-21)31-11-9-30(10-12-31)19-5-3-4-8-26-19/h3-8,13-14H,9-12H2,1-2H3,(H,29,32)