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

Systemtic Name: 2-butyl-1,3-bis(oxidanylidene)-N-(5-pentyl-1,3,4-thiadiazol-2-yl)isoindole-5-carboxamide Openeye Name: 2-butyl-1,3-dioxo-N-(5-pentyl-1,3,4-thiadiazol-2-yl)isoindoline-5-carboxamide CAS Name: 2-butyl-1,3-dioxo-N-(5-pentyl-1,3,4-thiadiazol-2-yl)-5-isoindolecarboxamide IUPAC Name: 2-butyl-1,3-dioxo-N-(5-pentyl-1,3,4-thiadiazol-2-yl)isoindole-5-carboxamide Traditional Name: N-(5-amyl-1,3,4-thiadiazol-2-yl)-2-butyl-1,3-diketo-isoindoline-5-carboxamide Formula: C20H24N4O3S MolecularWeight: 400.49456

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=NN=C(S1)NC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)CCCC

Isomeric SMILES

CCCCCC1=NN=C(S1)NC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)CCCC

InChI

InChI=1S/C20H24N4O3S/c1-3-5-7-8-16-22-23-20(28-16)21-17(25)13-9-10-14-15(12-13)19(27)24(18(14)26)11-6-4-2/h9-10,12H,3-8,11H2,1-2H3,(H,21,23,25)