6-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]-N-(1,3-thiazol-2-yl)hexanamide

Systemtic Name: 6-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]-N-(1,3-thiazol-2-yl)hexanamide Openeye Name: 6-(4-nitro-1,3-dioxo-isoindolin-2-yl)-N-thiazol-2-yl-hexanamide CAS Name: 6-(4-nitro-1,3-dioxo-2-isoindolyl)-N-(2-thiazolyl)hexanamide IUPAC Name: 6-(4-nitro-1,3-dioxoisoindol-2-yl)-N-(1,3-thiazol-2-yl)hexanamide Traditional Name: 6-(1,3-diketo-4-nitro-isoindolin-2-yl)-N-thiazol-2-yl-hexanamide Formula: C17H16N4O5S MolecularWeight: 388.39774

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)[N+](=O)[O-])C(=O)N(C2=O)CCCCCC(=O)NC3=NC=CS3

Isomeric SMILES

C1=CC2=C(C(=C1)[N+](=O)[O-])C(=O)N(C2=O)CCCCCC(=O)NC3=NC=CS3

InChI

InChI=1S/C17H16N4O5S/c22-13(19-17-18-8-10-27-17)7-2-1-3-9-20-15(23)11-5-4-6-12(21(25)26)14(11)16(20)24/h4-6,8,10H,1-3,7,9H2,(H,18,19,22)