3-(pentanoylcarbamothioylamino)-N-[3-(trifluoromethyl)phenyl]benzamide

Systemtic Name: 3-(pentanoylcarbamothioylamino)-N-[3-(trifluoromethyl)phenyl]benzamide Openeye Name: 3-(pentanoylcarbamothioylamino)-N-[3-(trifluoromethyl)phenyl]benzamide CAS Name: 3-[[(1-oxopentylamino)-sulfanylidenemethyl]amino]-N-[3-(trifluoromethyl)phenyl]benzamide IUPAC Name: 3-(pentanoylcarbamothioylamino)-N-[3-(trifluoromethyl)phenyl]benzamide Traditional Name: N-[3-(trifluoromethyl)phenyl]-3-(valerylthiocarbamoylamino)benzamide Formula: C20H20F3N3O2S MolecularWeight: 423.45191

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC(=S)NC1=CC=CC(=C1)C(=O)NC2=CC=CC(=C2)C(F)(F)F

Isomeric SMILES

CCCCC(=O)NC(=S)NC1=CC=CC(=C1)C(=O)NC2=CC=CC(=C2)C(F)(F)F

InChI

InChI=1S/C20H20F3N3O2S/c1-2-3-10-17(27)26-19(29)25-15-8-4-6-13(11-15)18(28)24-16-9-5-7-14(12-16)20(21,22)23/h4-9,11-12H,2-3,10H2,1H3,(H,24,28)(H2,25,26,27,29)