N-[2-(5-bromanyl-2-chloranyl-phenyl)-1,3-benzoxazol-5-yl]-3-chloranyl-7-nitro-1-benzothiophene-2-carboxamide

Systemtic Name: N-[2-(5-bromanyl-2-chloranyl-phenyl)-1,3-benzoxazol-5-yl]-3-chloranyl-7-nitro-1-benzothiophene-2-carboxamide Openeye Name: N-[2-(5-bromo-2-chloro-phenyl)-1,3-benzoxazol-5-yl]-3-chloro-7-nitro-benzothiophene-2-carboxamide CAS Name: N-[2-(5-bromo-2-chlorophenyl)-1,3-benzoxazol-5-yl]-3-chloro-7-nitro-1-benzothiophene-2-carboxamide IUPAC Name: N-[2-(5-bromo-2-chlorophenyl)-1,3-benzoxazol-5-yl]-3-chloro-7-nitro-1-benzothiophene-2-carboxamide Traditional Name: N-[2-(5-bromo-2-chloro-phenyl)-1,3-benzoxazol-5-yl]-3-chloro-7-nitro-benzothiophene-2-carboxamide Formula: C22H10BrCl2N3O4S MolecularWeight: 563.2075

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)[N+](=O)[O-])SC(=C2Cl)C(=O)NC3=CC4=C(C=C3)OC(=N4)C5=C(C=CC(=C5)Br)Cl

Isomeric SMILES

C1=CC2=C(C(=C1)[N+](=O)[O-])SC(=C2Cl)C(=O)NC3=CC4=C(C=C3)OC(=N4)C5=C(C=CC(=C5)Br)Cl

InChI

InChI=1S/C22H10BrCl2N3O4S/c23-10-4-6-14(24)13(8-10)22-27-15-9-11(5-7-17(15)32-22)26-21(29)20-18(25)12-2-1-3-16(28(30)31)19(12)33-20/h1-9H,(H,26,29)