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

Systemtic Name: N-(5-methyl-1,3,4-thiadiazol-2-yl)-3-[5-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]benzamide Openeye Name: N-(5-methyl-1,3,4-thiadiazol-2-yl)-3-(5-nitro-1,3-dioxo-isoindolin-2-yl)benzamide CAS Name: N-(5-methyl-1,3,4-thiadiazol-2-yl)-3-(5-nitro-1,3-dioxo-2-isoindolyl)benzamide IUPAC Name: N-(5-methyl-1,3,4-thiadiazol-2-yl)-3-(5-nitro-1,3-dioxoisoindol-2-yl)benzamide Traditional Name: 3-(1,3-diketo-5-nitro-isoindolin-2-yl)-N-(5-methyl-1,3,4-thiadiazol-2-yl)benzamide Formula: C18H11N5O5S MolecularWeight: 409.37544

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(S1)NC(=O)C2=CC(=CC=C2)N3C(=O)C4=C(C3=O)C=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=NN=C(S1)NC(=O)C2=CC(=CC=C2)N3C(=O)C4=C(C3=O)C=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C18H11N5O5S/c1-9-20-21-18(29-9)19-15(24)10-3-2-4-11(7-10)22-16(25)13-6-5-12(23(27)28)8-14(13)17(22)26/h2-8H,1H3,(H,19,21,24)