2-(2,3-dimethoxyphenyl)-N-[(5-nitro-2-oxidanyl-phenyl)methyl]-1,3-thiazole-4-carboxamide

Systemtic Name: 2-(2,3-dimethoxyphenyl)-N-[(5-nitro-2-oxidanyl-phenyl)methyl]-1,3-thiazole-4-carboxamide Openeye Name: 2-(2,3-dimethoxyphenyl)-N-[(2-hydroxy-5-nitro-phenyl)methyl]thiazole-4-carboxamide CAS Name: 2-(2,3-dimethoxyphenyl)-N-[(2-hydroxy-5-nitrophenyl)methyl]-4-thiazolecarboxamide IUPAC Name: 2-(2,3-dimethoxyphenyl)-N-[(2-hydroxy-5-nitrophenyl)methyl]-1,3-thiazole-4-carboxamide Traditional Name: 2-(2,3-dimethoxyphenyl)-N-(2-hydroxy-5-nitro-benzyl)thiazole-4-carboxamide Formula: C19H17N3O6S MolecularWeight: 415.41978

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)C2=NC(=CS2)C(=O)NCC3=C(C=CC(=C3)[N+](=O)[O-])O

Isomeric SMILES

COC1=CC=CC(=C1OC)C2=NC(=CS2)C(=O)NCC3=C(C=CC(=C3)[N+](=O)[O-])O

InChI

InChI=1S/C19H17N3O6S/c1-27-16-5-3-4-13(17(16)28-2)19-21-14(10-29-19)18(24)20-9-11-8-12(22(25)26)6-7-15(11)23/h3-8,10,23H,9H2,1-2H3,(H,20,24)