2-(4-chlorophenyl)-N-[2-(4-nitrophenyl)-2-oxidanyl-ethyl]-1,3-thiazole-4-carboxamide

Systemtic Name: 2-(4-chlorophenyl)-N-[2-(4-nitrophenyl)-2-oxidanyl-ethyl]-1,3-thiazole-4-carboxamide Openeye Name: 2-(4-chlorophenyl)-N-[2-hydroxy-2-(4-nitrophenyl)ethyl]thiazole-4-carboxamide CAS Name: 2-(4-chlorophenyl)-N-[2-hydroxy-2-(4-nitrophenyl)ethyl]-4-thiazolecarboxamide IUPAC Name: 2-(4-chlorophenyl)-N-[2-hydroxy-2-(4-nitrophenyl)ethyl]-1,3-thiazole-4-carboxamide Traditional Name: 2-(4-chlorophenyl)-N-[2-hydroxy-2-(4-nitrophenyl)ethyl]thiazole-4-carboxamide Formula: C18H14ClN3O4S MolecularWeight: 403.83946

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H14ClN3O4S/c19-13-5-1-12(2-6-13)18-21-15(10-27-18)17(24)20-9-16(23)11-3-7-14(8-4-11)22(25)26/h1-8,10,16,23H,9H2,(H,20,24)