N-[3-(dimethylamino)propyl]-N-(6-fluoranyl-1,3-benzothiazol-2-yl)-2-nitro-benzamide

Systemtic Name: N-[3-(dimethylamino)propyl]-N-(6-fluoranyl-1,3-benzothiazol-2-yl)-2-nitro-benzamide Openeye Name: N-[3-(dimethylamino)propyl]-N-(6-fluoro-1,3-benzothiazol-2-yl)-2-nitro-benzamide CAS Name: N-[3-(dimethylamino)propyl]-N-(6-fluoro-1,3-benzothiazol-2-yl)-2-nitrobenzamide IUPAC Name: N-[3-(dimethylamino)propyl]-N-(6-fluoro-1,3-benzothiazol-2-yl)-2-nitrobenzamide Traditional Name: N-[3-(dimethylamino)propyl]-N-(6-fluoro-1,3-benzothiazol-2-yl)-2-nitro-benzamide Formula: C19H19FN4O3S MolecularWeight: 402.442563

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCN(C1=NC2=C(S1)C=C(C=C2)F)C(=O)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CN(C)CCCN(C1=NC2=C(S1)C=C(C=C2)F)C(=O)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C19H19FN4O3S/c1-22(2)10-5-11-23(18(25)14-6-3-4-7-16(14)24(26)27)19-21-15-9-8-13(20)12-17(15)28-19/h3-4,6-9,12H,5,10-11H2,1-2H3