6-(5-methylsulfanyl-3-oxidanylidene-1H-isoindol-2-yl)-N-(4-piperazin-1-ylpyridin-3-yl)pyridine-2-carboxamide

Systemtic Name: 6-(5-methylsulfanyl-3-oxidanylidene-1H-isoindol-2-yl)-N-(4-piperazin-1-ylpyridin-3-yl)pyridine-2-carboxamide Openeye Name: 6-(6-methylsulfanyl-1-oxo-isoindolin-2-yl)-N-(4-piperazin-1-yl-3-pyridyl)pyridine-2-carboxamide CAS Name: 6-[5-(methylthio)-3-oxo-1H-isoindol-2-yl]-N-[4-(1-piperazinyl)-3-pyridinyl]-2-pyridinecarboxamide IUPAC Name: 6-(5-methylsulfanyl-3-oxo-1H-isoindol-2-yl)-N-(4-piperazin-1-ylpyridin-3-yl)pyridine-2-carboxamide Traditional Name: 6-[1-keto-6-(methylthio)isoindolin-2-yl]-N-(4-piperazino-3-pyridyl)picolinamide Formula: C24H24N6O2S MolecularWeight: 460.55136

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC2=C(CN(C2=O)C3=CC=CC(=N3)C(=O)NC4=C(C=CN=C4)N5CCNCC5)C=C1

Isomeric SMILES

CSC1=CC2=C(CN(C2=O)C3=CC=CC(=N3)C(=O)NC4=C(C=CN=C4)N5CCNCC5)C=C1

InChI

InChI=1S/C24H24N6O2S/c1-33-17-6-5-16-15-30(24(32)18(16)13-17)22-4-2-3-19(27-22)23(31)28-20-14-26-8-7-21(20)29-11-9-25-10-12-29/h2-8,13-14,25H,9-12,15H2,1H3,(H,28,31)