5-bromanyl-N-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]-1-benzofuran-2-carboxamide

Systemtic Name: 5-bromanyl-N-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]-1-benzofuran-2-carboxamide Openeye Name: 5-bromo-N-[4-(4-nitrophenyl)thiazol-2-yl]benzofuran-2-carboxamide CAS Name: 5-bromo-N-[4-(4-nitrophenyl)-2-thiazolyl]-2-benzofurancarboxamide IUPAC Name: 5-bromo-N-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]-1-benzofuran-2-carboxamide Traditional Name: 5-bromo-N-[4-(4-nitrophenyl)thiazol-2-yl]coumarilamide Formula: C18H10BrN3O4S MolecularWeight: 444.2587

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CSC(=N2)NC(=O)C3=CC4=C(O3)C=CC(=C4)Br)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C2=CSC(=N2)NC(=O)C3=CC4=C(O3)C=CC(=C4)Br)[N+](=O)[O-]

InChI

InChI=1S/C18H10BrN3O4S/c19-12-3-6-15-11(7-12)8-16(26-15)17(23)21-18-20-14(9-27-18)10-1-4-13(5-2-10)22(24)25/h1-9H,(H,20,21,23)