2-(5-methyl-1,3,4-thiadiazol-2-yl)-5-nitro-isoindole-1,3-dione

Systemtic Name: 2-(5-methyl-1,3,4-thiadiazol-2-yl)-5-nitro-isoindole-1,3-dione Openeye Name: 2-(5-methyl-1,3,4-thiadiazol-2-yl)-5-nitro-isoindoline-1,3-dione CAS Name: 2-(5-methyl-1,3,4-thiadiazol-2-yl)-5-nitroisoindole-1,3-dione IUPAC Name: 2-(5-methyl-1,3,4-thiadiazol-2-yl)-5-nitroisoindole-1,3-dione Traditional Name: 2-(5-methyl-1,3,4-thiadiazol-2-yl)-5-nitro-isoindoline-1,3-quinone Formula: C11H6N4O4S MolecularWeight: 290.25474

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(S1)N2C(=O)C3=C(C2=O)C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=NN=C(S1)N2C(=O)C3=C(C2=O)C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C11H6N4O4S/c1-5-12-13-11(20-5)14-9(16)7-3-2-6(15(18)19)4-8(7)10(14)17/h2-4H,1H3