N-[2-(4-bromophenyl)-1,3-benzoxazol-5-yl]-3-chloranyl-7-nitro-1-benzothiophene-2-carboxamide

Systemtic Name: N-[2-(4-bromophenyl)-1,3-benzoxazol-5-yl]-3-chloranyl-7-nitro-1-benzothiophene-2-carboxamide Openeye Name: N-[2-(4-bromophenyl)-1,3-benzoxazol-5-yl]-3-chloro-7-nitro-benzothiophene-2-carboxamide CAS Name: N-[2-(4-bromophenyl)-1,3-benzoxazol-5-yl]-3-chloro-7-nitro-1-benzothiophene-2-carboxamide IUPAC Name: N-[2-(4-bromophenyl)-1,3-benzoxazol-5-yl]-3-chloro-7-nitro-1-benzothiophene-2-carboxamide Traditional Name: N-[2-(4-bromophenyl)-1,3-benzoxazol-5-yl]-3-chloro-7-nitro-benzothiophene-2-carboxamide Formula: C22H11BrClN3O4S MolecularWeight: 528.76244

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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=CC=C(C=C5)Br

Isomeric SMILES

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

InChI

InChI=1S/C22H11BrClN3O4S/c23-12-6-4-11(5-7-12)22-26-15-10-13(8-9-17(15)31-22)25-21(28)20-18(24)14-2-1-3-16(27(29)30)19(14)32-20/h1-10H,(H,25,28)