6-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]-N-(5-propyl-1,3,4-thiadiazol-2-yl)hexanamide

Systemtic Name: 6-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]-N-(5-propyl-1,3,4-thiadiazol-2-yl)hexanamide Openeye Name: 6-(4-nitro-1,3-dioxo-isoindolin-2-yl)-N-(5-propyl-1,3,4-thiadiazol-2-yl)hexanamide CAS Name: 6-(4-nitro-1,3-dioxo-2-isoindolyl)-N-(5-propyl-1,3,4-thiadiazol-2-yl)hexanamide IUPAC Name: 6-(4-nitro-1,3-dioxoisoindol-2-yl)-N-(5-propyl-1,3,4-thiadiazol-2-yl)hexanamide Traditional Name: 6-(1,3-diketo-4-nitro-isoindolin-2-yl)-N-(5-propyl-1,3,4-thiadiazol-2-yl)hexanamide Formula: C19H21N5O5S MolecularWeight: 431.46554

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN=C(S1)NC(=O)CCCCCN2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CCCC1=NN=C(S1)NC(=O)CCCCCN2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H21N5O5S/c1-2-7-15-21-22-19(30-15)20-14(25)10-4-3-5-11-23-17(26)12-8-6-9-13(24(28)29)16(12)18(23)27/h6,8-9H,2-5,7,10-11H2,1H3,(H,20,22,25)