N-[4-(4-methoxy-3-nitro-phenyl)-5-methyl-1,3-thiazol-2-yl]-4-nitro-benzenesulfonamide

Systemtic Name: N-[4-(4-methoxy-3-nitro-phenyl)-5-methyl-1,3-thiazol-2-yl]-4-nitro-benzenesulfonamide Openeye Name: N-[4-(4-methoxy-3-nitro-phenyl)-5-methyl-thiazol-2-yl]-4-nitro-benzenesulfonamide CAS Name: N-[4-(4-methoxy-3-nitrophenyl)-5-methyl-2-thiazolyl]-4-nitrobenzenesulfonamide IUPAC Name: N-[4-(4-methoxy-3-nitrophenyl)-5-methyl-1,3-thiazol-2-yl]-4-nitrobenzenesulfonamide Traditional Name: N-[4-(4-methoxy-3-nitro-phenyl)-5-methyl-thiazol-2-yl]-4-nitro-benzenesulfonamide Formula: C17H14N4O7S2 MolecularWeight: 450.44566

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(S1)NS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-])C3=CC(=C(C=C3)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=C(N=C(S1)NS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-])C3=CC(=C(C=C3)OC)[N+](=O)[O-]

InChI

InChI=1S/C17H14N4O7S2/c1-10-16(11-3-8-15(28-2)14(9-11)21(24)25)18-17(29-10)19-30(26,27)13-6-4-12(5-7-13)20(22)23/h3-9H,1-2H3,(H,18,19)