4-[[3-pyrrolidin-1-yl-5-(trifluoromethyl)phenyl]carbamothioylamino]benzamide

Systemtic Name: 4-[[3-pyrrolidin-1-yl-5-(trifluoromethyl)phenyl]carbamothioylamino]benzamide Openeye Name: 4-[[3-pyrrolidin-1-yl-5-(trifluoromethyl)phenyl]carbamothioylamino]benzamide CAS Name: 4-[[[3-(1-pyrrolidinyl)-5-(trifluoromethyl)anilino]-sulfanylidenemethyl]amino]benzamide IUPAC Name: 4-[[3-pyrrolidin-1-yl-5-(trifluoromethyl)phenyl]carbamothioylamino]benzamide Traditional Name: 4-[[3-pyrrolidino-5-(trifluoromethyl)phenyl]thiocarbamoylamino]benzamide Formula: C19H19F3N4OS MolecularWeight: 408.44057

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=CC(=CC(=C2)C(F)(F)F)NC(=S)NC3=CC=C(C=C3)C(=O)N

Isomeric SMILES

C1CCN(C1)C2=CC(=CC(=C2)C(F)(F)F)NC(=S)NC3=CC=C(C=C3)C(=O)N

InChI

InChI=1S/C19H19F3N4OS/c20-19(21,22)13-9-15(11-16(10-13)26-7-1-2-8-26)25-18(28)24-14-5-3-12(4-6-14)17(23)27/h3-6,9-11H,1-2,7-8H2,(H2,23,27)(H2,24,25,28)