N-[2-(1,3-benzothiazol-2-yl)-4-bromanyl-phenyl]-5-nitro-furan-2-carboxamide

Systemtic Name: N-[2-(1,3-benzothiazol-2-yl)-4-bromanyl-phenyl]-5-nitro-furan-2-carboxamide Openeye Name: N-[2-(1,3-benzothiazol-2-yl)-4-bromo-phenyl]-5-nitro-furan-2-carboxamide CAS Name: N-[2-(1,3-benzothiazol-2-yl)-4-bromophenyl]-5-nitro-2-furancarboxamide IUPAC Name: N-[2-(1,3-benzothiazol-2-yl)-4-bromophenyl]-5-nitrofuran-2-carboxamide Traditional Name: N-[2-(1,3-benzothiazol-2-yl)-4-bromo-phenyl]-5-nitro-2-furamide Formula: C18H10BrN3O4S MolecularWeight: 444.2587

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)C3=C(C=CC(=C3)Br)NC(=O)C4=CC=C(O4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)C3=C(C=CC(=C3)Br)NC(=O)C4=CC=C(O4)[N+](=O)[O-]

InChI

InChI=1S/C18H10BrN3O4S/c19-10-5-6-12(20-17(23)14-7-8-16(26-14)22(24)25)11(9-10)18-21-13-3-1-2-4-15(13)27-18/h1-9H,(H,20,23)