N-[4,6-bis(fluoranyl)-1,3-benzothiazol-2-yl]-N-(2-dimethylaminoethyl)-5-nitro-thiophene-2-carboxamide

Systemtic Name: N-[4,6-bis(fluoranyl)-1,3-benzothiazol-2-yl]-N-(2-dimethylaminoethyl)-5-nitro-thiophene-2-carboxamide Openeye Name: N-(4,6-difluoro-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-5-nitro-thiophene-2-carboxamide CAS Name: N-(4,6-difluoro-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-5-nitro-2-thiophenecarboxamide IUPAC Name: N-(4,6-difluoro-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-5-nitrothiophene-2-carboxamide Traditional Name: N-(4,6-difluoro-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-5-nitro-thiophene-2-carboxamide Formula: C16H14F2N4O3S2 MolecularWeight: 412.434166

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCN(C1=NC2=C(C=C(C=C2S1)F)F)C(=O)C3=CC=C(S3)[N+](=O)[O-]

Isomeric SMILES

CN(C)CCN(C1=NC2=C(C=C(C=C2S1)F)F)C(=O)C3=CC=C(S3)[N+](=O)[O-]

InChI

InChI=1S/C16H14F2N4O3S2/c1-20(2)5-6-21(15(23)11-3-4-13(26-11)22(24)25)16-19-14-10(18)7-9(17)8-12(14)27-16/h3-4,7-8H,5-6H2,1-2H3