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

Systemtic Name: 2,5-dimethyl-4-(4-pyridin-2-ylpiperazin-1-yl)-N-quinolin-3-yl-thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: 2,5-dimethyl-4-[4-(2-pyridyl)piperazin-1-yl]-N-(3-quinolyl)thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: 2,5-dimethyl-4-[4-(2-pyridinyl)-1-piperazinyl]-N-(3-quinolinyl)-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: 2,5-dimethyl-4-(4-pyridin-2-ylpiperazin-1-yl)-N-quinolin-3-ylthieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: 2,5-dimethyl-4-[4-(2-pyridyl)piperazino]-N-(3-quinolyl)thieno[2,3-d]pyrimidine-6-carboxamide Formula: C27H25N7OS MolecularWeight: 495.5987

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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=CC6=CC=CC=C6N=C5

Isomeric SMILES

CC1=C(SC2=NC(=NC(=C12)N3CCN(CC3)C4=CC=CC=N4)C)C(=O)NC5=CC6=CC=CC=C6N=C5

InChI

InChI=1S/C27H25N7OS/c1-17-23-25(34-13-11-33(12-14-34)22-9-5-6-10-28-22)30-18(2)31-27(23)36-24(17)26(35)32-20-15-19-7-3-4-8-21(19)29-16-20/h3-10,15-16H,11-14H2,1-2H3,(H,32,35)