N-[4-methyl-2-(4-pyrimidin-2-ylpiperazin-1-yl)quinolin-6-yl]-2-thiophen-2-yl-ethanamide

Systemtic Name: N-[4-methyl-2-(4-pyrimidin-2-ylpiperazin-1-yl)quinolin-6-yl]-2-thiophen-2-yl-ethanamide Openeye Name: N-[4-methyl-2-(4-pyrimidin-2-ylpiperazin-1-yl)-6-quinolyl]-2-(2-thienyl)acetamide CAS Name: N-[4-methyl-2-[4-(2-pyrimidinyl)-1-piperazinyl]-6-quinolinyl]-2-thiophen-2-ylacetamide IUPAC Name: N-[4-methyl-2-(4-pyrimidin-2-ylpiperazin-1-yl)quinolin-6-yl]-2-thiophen-2-ylacetamide Traditional Name: N-[4-methyl-2-[4-(2-pyrimidyl)piperazino]-6-quinolyl]-2-(2-thienyl)acetamide Formula: C24H24N6OS MolecularWeight: 444.55196

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=C1C=C(C=C2)NC(=O)CC3=CC=CS3)N4CCN(CC4)C5=NC=CC=N5

Isomeric SMILES

CC1=CC(=NC2=C1C=C(C=C2)NC(=O)CC3=CC=CS3)N4CCN(CC4)C5=NC=CC=N5

InChI

InChI=1S/C24H24N6OS/c1-17-14-22(29-9-11-30(12-10-29)24-25-7-3-8-26-24)28-21-6-5-18(15-20(17)21)27-23(31)16-19-4-2-13-32-19/h2-8,13-15H,9-12,16H2,1H3,(H,27,31)