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

Systemtic Name: N-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-(4-fluorophenyl)sulfanyl-3-nitro-benzamide Openeye Name: N-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-(4-fluorophenyl)sulfanyl-3-nitro-benzamide CAS Name: N-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-[(4-fluorophenyl)thio]-3-nitrobenzamide IUPAC Name: N-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-(4-fluorophenyl)sulfanyl-3-nitrobenzamide Traditional Name: N-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-[(4-fluorophenyl)thio]-3-nitro-benzamide Formula: C17H13FN4O3S2 MolecularWeight: 404.438523

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN=C(S1)NC(=O)C2=CC(=C(C=C2)SC3=CC=C(C=C3)F)[N+](=O)[O-]

Isomeric SMILES

CCC1=NN=C(S1)NC(=O)C2=CC(=C(C=C2)SC3=CC=C(C=C3)F)[N+](=O)[O-]

InChI

InChI=1S/C17H13FN4O3S2/c1-2-15-20-21-17(27-15)19-16(23)10-3-8-14(13(9-10)22(24)25)26-12-6-4-11(18)5-7-12/h3-9H,2H2,1H3,(H,19,21,23)