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

Systemtic Name: N-(5-methyl-1,3,4-thiadiazol-2-yl)-4-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]butanamide Openeye Name: N-(5-methyl-1,3,4-thiadiazol-2-yl)-4-(4-nitro-1,3-dioxo-isoindolin-2-yl)butanamide CAS Name: N-(5-methyl-1,3,4-thiadiazol-2-yl)-4-(4-nitro-1,3-dioxo-2-isoindolyl)butanamide IUPAC Name: N-(5-methyl-1,3,4-thiadiazol-2-yl)-4-(4-nitro-1,3-dioxoisoindol-2-yl)butanamide Traditional Name: 4-(1,3-diketo-4-nitro-isoindolin-2-yl)-N-(5-methyl-1,3,4-thiadiazol-2-yl)butyramide Formula: C15H13N5O5S MolecularWeight: 375.35922

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(S1)NC(=O)CCCN2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=NN=C(S1)NC(=O)CCCN2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C15H13N5O5S/c1-8-17-18-15(26-8)16-11(21)6-3-7-19-13(22)9-4-2-5-10(20(24)25)12(9)14(19)23/h2,4-5H,3,6-7H2,1H3,(H,16,18,21)