6-bromanyl-3-chloranyl-N-[(E)-1-(4-nitrophenyl)ethylideneamino]-1-benzothiophene-2-carboxamide

Systemtic Name: 6-bromanyl-3-chloranyl-N-[(E)-1-(4-nitrophenyl)ethylideneamino]-1-benzothiophene-2-carboxamide Openeye Name: 6-bromo-3-chloro-N-[(E)-1-(4-nitrophenyl)ethylideneamino]benzothiophene-2-carboxamide CAS Name: 6-bromo-3-chloro-N-[(E)-1-(4-nitrophenyl)ethylideneamino]-1-benzothiophene-2-carboxamide IUPAC Name: 6-bromo-3-chloro-N-[(E)-1-(4-nitrophenyl)ethylideneamino]-1-benzothiophene-2-carboxamide Traditional Name: 6-bromo-3-chloro-N-[(E)-1-(4-nitrophenyl)ethylideneamino]benzothiophene-2-carboxamide Formula: C17H11BrClN3O3S MolecularWeight: 452.70954

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C1=C(C2=C(S1)C=C(C=C2)Br)Cl)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C/C(=N\NC(=O)C1=C(C2=C(S1)C=C(C=C2)Br)Cl)/C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H11BrClN3O3S/c1-9(10-2-5-12(6-3-10)22(24)25)20-21-17(23)16-15(19)13-7-4-11(18)8-14(13)26-16/h2-8H,1H3,(H,21,23)/b20-9+