2-(1,3-benzoxazol-2-ylsulfanyl)-N-(2-bromanyl-4-nitro-phenyl)ethanamide

Systemtic Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-N-(2-bromanyl-4-nitro-phenyl)ethanamide Openeye Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-N-(2-bromo-4-nitro-phenyl)acetamide CAS Name: 2-(1,3-benzoxazol-2-ylthio)-N-(2-bromo-4-nitrophenyl)acetamide IUPAC Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-N-(2-bromo-4-nitrophenyl)acetamide Traditional Name: 2-(1,3-benzoxazol-2-ylthio)-N-(2-bromo-4-nitro-phenyl)acetamide Formula: C15H10BrN3O4S MolecularWeight: 408.2266

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(O2)SCC(=O)NC3=C(C=C(C=C3)[N+](=O)[O-])Br

Isomeric SMILES

C1=CC=C2C(=C1)N=C(O2)SCC(=O)NC3=C(C=C(C=C3)[N+](=O)[O-])Br

InChI

InChI=1S/C15H10BrN3O4S/c16-10-7-9(19(21)22)5-6-11(10)17-14(20)8-24-15-18-12-3-1-2-4-13(12)23-15/h1-7H,8H2,(H,17,20)