2-butyl-1,3-bis(oxidanylidene)-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)isoindole-5-carboxamide

Systemtic Name: 2-butyl-1,3-bis(oxidanylidene)-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)isoindole-5-carboxamide Openeye Name: 2-butyl-1,3-dioxo-N-[4-(2-pyridyl)thiazol-2-yl]isoindoline-5-carboxamide CAS Name: 2-butyl-1,3-dioxo-N-[4-(2-pyridinyl)-2-thiazolyl]-5-isoindolecarboxamide IUPAC Name: 2-butyl-1,3-dioxo-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)isoindole-5-carboxamide Traditional Name: 2-butyl-1,3-diketo-N-[4-(2-pyridyl)thiazol-2-yl]isoindoline-5-carboxamide Formula: C21H18N4O3S MolecularWeight: 406.45762

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NC3=NC(=CS3)C4=CC=CC=N4

Isomeric SMILES

CCCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NC3=NC(=CS3)C4=CC=CC=N4

InChI

InChI=1S/C21H18N4O3S/c1-2-3-10-25-19(27)14-8-7-13(11-15(14)20(25)28)18(26)24-21-23-17(12-29-21)16-6-4-5-9-22-16/h4-9,11-12H,2-3,10H2,1H3,(H,23,24,26)