2-(2-methylpropyl)-N-(5-nitro-1,3-thiazol-2-yl)-1,3-bis(oxidanylidene)isoindole-5-carboxamide

Systemtic Name: 2-(2-methylpropyl)-N-(5-nitro-1,3-thiazol-2-yl)-1,3-bis(oxidanylidene)isoindole-5-carboxamide Openeye Name: 2-isobutyl-N-(5-nitrothiazol-2-yl)-1,3-dioxo-isoindoline-5-carboxamide CAS Name: 2-(2-methylpropyl)-N-(5-nitro-2-thiazolyl)-1,3-dioxo-5-isoindolecarboxamide IUPAC Name: 2-(2-methylpropyl)-N-(5-nitro-1,3-thiazol-2-yl)-1,3-dioxoisoindole-5-carboxamide Traditional Name: 2-isobutyl-1,3-diketo-N-(5-nitrothiazol-2-yl)isoindoline-5-carboxamide Formula: C16H14N4O5S MolecularWeight: 374.37116

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NC3=NC=C(S3)[N+](=O)[O-]

Isomeric SMILES

CC(C)CN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NC3=NC=C(S3)[N+](=O)[O-]

InChI

InChI=1S/C16H14N4O5S/c1-8(2)7-19-14(22)10-4-3-9(5-11(10)15(19)23)13(21)18-16-17-6-12(26-16)20(24)25/h3-6,8H,7H2,1-2H3,(H,17,18,21)