4-ethoxy-N-[5-[(8-fluoranyl-4-oxidanylidene-1H-quinolin-2-yl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]benzamide

Systemtic Name: 4-ethoxy-N-[5-[(8-fluoranyl-4-oxidanylidene-1H-quinolin-2-yl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]benzamide Openeye Name: 4-ethoxy-N-[5-[(8-fluoro-4-oxo-1H-quinolin-2-yl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]benzamide CAS Name: 4-ethoxy-N-[5-[(8-fluoro-4-oxo-1H-quinolin-2-yl)methylthio]-1,3,4-thiadiazol-2-yl]benzamide IUPAC Name: 4-ethoxy-N-[5-[(8-fluoro-4-oxo-1H-quinolin-2-yl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]benzamide Traditional Name: 4-ethoxy-N-[5-[(8-fluoro-4-keto-1H-quinolin-2-yl)methylthio]-1,3,4-thiadiazol-2-yl]benzamide Formula: C21H17FN4O3S2 MolecularWeight: 456.513083

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)NC2=NN=C(S2)SCC3=CC(=O)C4=C(N3)C(=CC=C4)F

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)NC2=NN=C(S2)SCC3=CC(=O)C4=C(N3)C(=CC=C4)F

InChI

InChI=1S/C21H17FN4O3S2/c1-2-29-14-8-6-12(7-9-14)19(28)24-20-25-26-21(31-20)30-11-13-10-17(27)15-4-3-5-16(22)18(15)23-13/h3-10H,2,11H2,1H3,(H,23,27)(H,24,25,28)