N-[4,6-bis(bromanyl)-1,3-benzothiazol-2-yl]-2-nitro-benzamide

Systemtic Name: N-[4,6-bis(bromanyl)-1,3-benzothiazol-2-yl]-2-nitro-benzamide Openeye Name: N-(4,6-dibromo-1,3-benzothiazol-2-yl)-2-nitro-benzamide CAS Name: N-(4,6-dibromo-1,3-benzothiazol-2-yl)-2-nitrobenzamide IUPAC Name: N-(4,6-dibromo-1,3-benzothiazol-2-yl)-2-nitrobenzamide Traditional Name: N-(4,6-dibromo-1,3-benzothiazol-2-yl)-2-nitro-benzamide Formula: C14H7Br2N3O3S MolecularWeight: 457.09668

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NC2=NC3=C(C=C(C=C3S2)Br)Br)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NC2=NC3=C(C=C(C=C3S2)Br)Br)[N+](=O)[O-]

InChI

InChI=1S/C14H7Br2N3O3S/c15-7-5-9(16)12-11(6-7)23-14(17-12)18-13(20)8-3-1-2-4-10(8)19(21)22/h1-6H,(H,17,18,20)