N-[4-(4-methyl-3-nitro-phenyl)-1,3-thiazol-2-yl]-4-nitro-benzenesulfonamide

Systemtic Name: N-[4-(4-methyl-3-nitro-phenyl)-1,3-thiazol-2-yl]-4-nitro-benzenesulfonamide Openeye Name: N-[4-(4-methyl-3-nitro-phenyl)thiazol-2-yl]-4-nitro-benzenesulfonamide CAS Name: N-[4-(4-methyl-3-nitrophenyl)-2-thiazolyl]-4-nitrobenzenesulfonamide IUPAC Name: N-[4-(4-methyl-3-nitrophenyl)-1,3-thiazol-2-yl]-4-nitrobenzenesulfonamide Traditional Name: N-[4-(4-methyl-3-nitro-phenyl)thiazol-2-yl]-4-nitro-benzenesulfonamide Formula: C16H12N4O6S2 MolecularWeight: 420.41968

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=CSC(=N2)NS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C2=CSC(=N2)NS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C16H12N4O6S2/c1-10-2-3-11(8-15(10)20(23)24)14-9-27-16(17-14)18-28(25,26)13-6-4-12(5-7-13)19(21)22/h2-9H,1H3,(H,17,18)