N-[5-[2-[(4-fluorophenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-2-nitro-benzamide

Systemtic Name: N-[5-[2-[(4-fluorophenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-2-nitro-benzamide Openeye Name: N-[5-[2-(4-fluoroanilino)-2-oxo-ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-2-nitro-benzamide CAS Name: N-[5-[[2-(4-fluoroanilino)-2-oxoethyl]thio]-1,3,4-thiadiazol-2-yl]-2-nitrobenzamide IUPAC Name: N-[5-[2-(4-fluoroanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-2-nitrobenzamide Traditional Name: N-[5-[[2-(4-fluoroanilino)-2-keto-ethyl]thio]-1,3,4-thiadiazol-2-yl]-2-nitro-benzamide Formula: C17H12FN5O4S2 MolecularWeight: 433.436683

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NC2=NN=C(S2)SCC(=O)NC3=CC=C(C=C3)F)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NC2=NN=C(S2)SCC(=O)NC3=CC=C(C=C3)F)[N+](=O)[O-]

InChI

InChI=1S/C17H12FN5O4S2/c18-10-5-7-11(8-6-10)19-14(24)9-28-17-22-21-16(29-17)20-15(25)12-3-1-2-4-13(12)23(26)27/h1-8H,9H2,(H,19,24)(H,20,21,25)