N-(5-methyl-4-oxidanylidene-1,3-thiazol-2-yl)-4-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]butanamide

Systemtic Name: N-(5-methyl-4-oxidanylidene-1,3-thiazol-2-yl)-4-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]butanamide Openeye Name: N-(5-methyl-4-oxo-thiazol-2-yl)-4-(4-nitro-1,3-dioxo-isoindolin-2-yl)butanamide CAS Name: N-(5-methyl-4-oxo-2-thiazolyl)-4-(4-nitro-1,3-dioxo-2-isoindolyl)butanamide IUPAC Name: N-(5-methyl-4-oxo-1,3-thiazol-2-yl)-4-(4-nitro-1,3-dioxoisoindol-2-yl)butanamide Traditional Name: 4-(1,3-diketo-4-nitro-isoindolin-2-yl)-N-(4-keto-5-methyl-2-thiazolin-2-yl)butyramide Formula: C16H14N4O6S MolecularWeight: 390.37056

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N=C(S1)NC(=O)CCCN2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1C(=O)N=C(S1)NC(=O)CCCN2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H14N4O6S/c1-8-13(22)18-16(27-8)17-11(21)6-3-7-19-14(23)9-4-2-5-10(20(25)26)12(9)15(19)24/h2,4-5,8H,3,6-7H2,1H3,(H,17,18,21,22)