3-(2-ethylbutanoylamino)-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]benzamide

Systemtic Name: 3-(2-ethylbutanoylamino)-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]benzamide Openeye Name: 3-(2-ethylbutanoylamino)-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]benzamide CAS Name: 3-[(2-ethyl-1-oxobutyl)amino]-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]benzamide IUPAC Name: 3-(2-ethylbutanoylamino)-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]benzamide Traditional Name: 3-(2-ethylbutanoylamino)-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]benzamide Formula: C16H17F3N4O2S MolecularWeight: 386.39199

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C(=O)NC1=CC=CC(=C1)C(=O)NC2=NN=C(S2)C(F)(F)F

Isomeric SMILES

CCC(CC)C(=O)NC1=CC=CC(=C1)C(=O)NC2=NN=C(S2)C(F)(F)F

InChI

InChI=1S/C16H17F3N4O2S/c1-3-9(4-2)12(24)20-11-7-5-6-10(8-11)13(25)21-15-23-22-14(26-15)16(17,18)19/h5-9H,3-4H2,1-2H3,(H,20,24)(H,21,23,25)