3-methyl-N-(5-phenyl-1,3,4-thiadiazol-2-yl)-2-[[2-(trifluoromethyl)phenyl]carbamoylamino]butanamide

Systemtic Name: 3-methyl-N-(5-phenyl-1,3,4-thiadiazol-2-yl)-2-[[2-(trifluoromethyl)phenyl]carbamoylamino]butanamide Openeye Name: 3-methyl-N-(5-phenyl-1,3,4-thiadiazol-2-yl)-2-[[2-(trifluoromethyl)phenyl]carbamoylamino]butanamide CAS Name: 3-methyl-2-[[oxo-[2-(trifluoromethyl)anilino]methyl]amino]-N-(5-phenyl-1,3,4-thiadiazol-2-yl)butanamide IUPAC Name: 3-methyl-N-(5-phenyl-1,3,4-thiadiazol-2-yl)-2-[[2-(trifluoromethyl)phenyl]carbamoylamino]butanamide Traditional Name: 3-methyl-N-(5-phenyl-1,3,4-thiadiazol-2-yl)-2-[[2-(trifluoromethyl)phenyl]carbamoylamino]butyramide Formula: C21H20F3N5O2S MolecularWeight: 463.47601

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1=NN=C(S1)C2=CC=CC=C2)NC(=O)NC3=CC=CC=C3C(F)(F)F

Isomeric SMILES

CC(C)C(C(=O)NC1=NN=C(S1)C2=CC=CC=C2)NC(=O)NC3=CC=CC=C3C(F)(F)F

InChI

InChI=1S/C21H20F3N5O2S/c1-12(2)16(26-19(31)25-15-11-7-6-10-14(15)21(22,23)24)17(30)27-20-29-28-18(32-20)13-8-4-3-5-9-13/h3-12,16H,1-2H3,(H2,25,26,31)(H,27,29,30)