2-[[2-(4-chlorophenyl)-1,3-thiazol-4-yl]methyl]-5-nitro-isoindole-1,3-dione

Systemtic Name: 2-[[2-(4-chlorophenyl)-1,3-thiazol-4-yl]methyl]-5-nitro-isoindole-1,3-dione Openeye Name: 2-[[2-(4-chlorophenyl)thiazol-4-yl]methyl]-5-nitro-isoindoline-1,3-dione CAS Name: 2-[[2-(4-chlorophenyl)-4-thiazolyl]methyl]-5-nitroisoindole-1,3-dione IUPAC Name: 2-[[2-(4-chlorophenyl)-1,3-thiazol-4-yl]methyl]-5-nitroisoindole-1,3-dione Traditional Name: 2-[[2-(4-chlorophenyl)thiazol-4-yl]methyl]-5-nitro-isoindoline-1,3-quinone Formula: C18H10ClN3O4S MolecularWeight: 399.8077

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NC(=CS2)CN3C(=O)C4=C(C3=O)C=C(C=C4)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC(=CC=C1C2=NC(=CS2)CN3C(=O)C4=C(C3=O)C=C(C=C4)[N+](=O)[O-])Cl

InChI

InChI=1S/C18H10ClN3O4S/c19-11-3-1-10(2-4-11)16-20-12(9-27-16)8-21-17(23)14-6-5-13(22(25)26)7-15(14)18(21)24/h1-7,9H,8H2