3-(prop-2-enylcarbamothioylamino)-N-[3-(trifluoromethyl)phenyl]benzamide

Systemtic Name: 3-(prop-2-enylcarbamothioylamino)-N-[3-(trifluoromethyl)phenyl]benzamide Openeye Name: 3-(allylcarbamothioylamino)-N-[3-(trifluoromethyl)phenyl]benzamide CAS Name: 3-[[(prop-2-enylamino)-sulfanylidenemethyl]amino]-N-[3-(trifluoromethyl)phenyl]benzamide IUPAC Name: 3-(prop-2-enylcarbamothioylamino)-N-[3-(trifluoromethyl)phenyl]benzamide Traditional Name: 3-(allylthiocarbamoylamino)-N-[3-(trifluoromethyl)phenyl]benzamide Formula: C18H16F3N3OS MolecularWeight: 379.39935

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H16F3N3OS/c1-2-9-22-17(26)24-14-7-3-5-12(10-14)16(25)23-15-8-4-6-13(11-15)18(19,20)21/h2-8,10-11H,1,9H2,(H,23,25)(H2,22,24,26)