N-(5-fluoranyl-2-piperazin-1-yl-phenyl)-2-(5-methoxy-3-oxidanylidene-1H-isoindol-2-yl)-1,3-thiazole-4-carboxamide

Systemtic Name: N-(5-fluoranyl-2-piperazin-1-yl-phenyl)-2-(5-methoxy-3-oxidanylidene-1H-isoindol-2-yl)-1,3-thiazole-4-carboxamide Openeye Name: N-(5-fluoro-2-piperazin-1-yl-phenyl)-2-(6-methoxy-1-oxo-isoindolin-2-yl)thiazole-4-carboxamide CAS Name: N-[5-fluoro-2-(1-piperazinyl)phenyl]-2-(5-methoxy-3-oxo-1H-isoindol-2-yl)-4-thiazolecarboxamide IUPAC Name: N-(5-fluoro-2-piperazin-1-ylphenyl)-2-(5-methoxy-3-oxo-1H-isoindol-2-yl)-1,3-thiazole-4-carboxamide Traditional Name: N-(5-fluoro-2-piperazino-phenyl)-2-(1-keto-6-methoxy-isoindolin-2-yl)thiazole-4-carboxamide Formula: C23H22FN5O3S MolecularWeight: 467.515883

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(CN(C2=O)C3=NC(=CS3)C(=O)NC4=C(C=CC(=C4)F)N5CCNCC5)C=C1

Isomeric SMILES

COC1=CC2=C(CN(C2=O)C3=NC(=CS3)C(=O)NC4=C(C=CC(=C4)F)N5CCNCC5)C=C1

InChI

InChI=1S/C23H22FN5O3S/c1-32-16-4-2-14-12-29(22(31)17(14)11-16)23-27-19(13-33-23)21(30)26-18-10-15(24)3-5-20(18)28-8-6-25-7-9-28/h2-5,10-11,13,25H,6-9,12H2,1H3,(H,26,30)