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

Systemtic Name: N-(5-chloranyl-2-methoxy-phenyl)-2,5-dimethyl-4-(4-pyridin-2-ylpiperazin-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: N-(5-chloro-2-methoxy-phenyl)-2,5-dimethyl-4-[4-(2-pyridyl)piperazin-1-yl]thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: N-(5-chloro-2-methoxyphenyl)-2,5-dimethyl-4-[4-(2-pyridinyl)-1-piperazinyl]-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: N-(5-chloro-2-methoxyphenyl)-2,5-dimethyl-4-(4-pyridin-2-ylpiperazin-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: N-(5-chloro-2-methoxy-phenyl)-2,5-dimethyl-4-[4-(2-pyridyl)piperazino]thieno[2,3-d]pyrimidine-6-carboxamide Formula: C25H25ClN6O2S MolecularWeight: 509.023

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC(=NC(=C12)N3CCN(CC3)C4=CC=CC=N4)C)C(=O)NC5=C(C=CC(=C5)Cl)OC

Isomeric SMILES

CC1=C(SC2=NC(=NC(=C12)N3CCN(CC3)C4=CC=CC=N4)C)C(=O)NC5=C(C=CC(=C5)Cl)OC

InChI

InChI=1S/C25H25ClN6O2S/c1-15-21-23(32-12-10-31(11-13-32)20-6-4-5-9-27-20)28-16(2)29-25(21)35-22(15)24(33)30-18-14-17(26)7-8-19(18)34-3/h4-9,14H,10-13H2,1-3H3,(H,30,33)