N-(2-dimethylaminoethyl)-N-(4-fluoranyl-1,3-benzothiazol-2-yl)-4-nitro-benzamide

Systemtic Name: N-(2-dimethylaminoethyl)-N-(4-fluoranyl-1,3-benzothiazol-2-yl)-4-nitro-benzamide Openeye Name: N-(2-dimethylaminoethyl)-N-(4-fluoro-1,3-benzothiazol-2-yl)-4-nitro-benzamide CAS Name: N-(2-dimethylaminoethyl)-N-(4-fluoro-1,3-benzothiazol-2-yl)-4-nitrobenzamide IUPAC Name: N-(2-dimethylaminoethyl)-N-(4-fluoro-1,3-benzothiazol-2-yl)-4-nitrobenzamide Traditional Name: N-(2-dimethylaminoethyl)-N-(4-fluoro-1,3-benzothiazol-2-yl)-4-nitro-benzamide Formula: C18H17FN4O3S MolecularWeight: 388.415983

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCN(C1=NC2=C(C=CC=C2S1)F)C(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CN(C)CCN(C1=NC2=C(C=CC=C2S1)F)C(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H17FN4O3S/c1-21(2)10-11-22(17(24)12-6-8-13(9-7-12)23(25)26)18-20-16-14(19)4-3-5-15(16)27-18/h3-9H,10-11H2,1-2H3