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

Systemtic Name: 2-(5-methyl-1,3-thiazol-2-yl)-5-nitro-isoindole-1,3-dione Openeye Name: 2-(5-methylthiazol-2-yl)-5-nitro-isoindoline-1,3-dione CAS Name: 2-(5-methyl-2-thiazolyl)-5-nitroisoindole-1,3-dione IUPAC Name: 2-(5-methyl-1,3-thiazol-2-yl)-5-nitroisoindole-1,3-dione Traditional Name: 2-(5-methylthiazol-2-yl)-5-nitro-isoindoline-1,3-quinone Formula: C12H7N3O4S MolecularWeight: 289.26668

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H7N3O4S/c1-6-5-13-12(20-6)14-10(16)8-3-2-7(15(18)19)4-9(8)11(14)17/h2-5H,1H3