2-(aminocarbonylamino)-4-methylsulfanyl-N-[[3-(trifluoromethyl)phenyl]methyl]butanamide

Systemtic Name: 2-(aminocarbonylamino)-4-methylsulfanyl-N-[[3-(trifluoromethyl)phenyl]methyl]butanamide Openeye Name: 4-methylsulfanyl-N-[[3-(trifluoromethyl)phenyl]methyl]-2-ureido-butanamide CAS Name: 2-(carbamoylamino)-4-(methylthio)-N-[[3-(trifluoromethyl)phenyl]methyl]butanamide IUPAC Name: 2-(carbamoylamino)-4-methylsulfanyl-N-[[3-(trifluoromethyl)phenyl]methyl]butanamide Traditional Name: 4-(methylthio)-N-[3-(trifluoromethyl)benzyl]-2-ureido-butyramide Formula: C14H18F3N3O2S MolecularWeight: 349.37183

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)NCC1=CC(=CC=C1)C(F)(F)F)NC(=O)N

Isomeric SMILES

CSCCC(C(=O)NCC1=CC(=CC=C1)C(F)(F)F)NC(=O)N

InChI

InChI=1S/C14H18F3N3O2S/c1-23-6-5-11(20-13(18)22)12(21)19-8-9-3-2-4-10(7-9)14(15,16)17/h2-4,7,11H,5-6,8H2,1H3,(H,19,21)(H3,18,20,22)