3-(2-dimethylaminoethylcarbamothioylamino)-N-[3-(trifluoromethyl)phenyl]benzamide

Systemtic Name: 3-(2-dimethylaminoethylcarbamothioylamino)-N-[3-(trifluoromethyl)phenyl]benzamide Openeye Name: 3-(2-dimethylaminoethylcarbamothioylamino)-N-[3-(trifluoromethyl)phenyl]benzamide CAS Name: 3-[[(2-dimethylaminoethylamino)-sulfanylidenemethyl]amino]-N-[3-(trifluoromethyl)phenyl]benzamide IUPAC Name: 3-(2-dimethylaminoethylcarbamothioylamino)-N-[3-(trifluoromethyl)phenyl]benzamide Traditional Name: 3-(2-dimethylaminoethylthiocarbamoylamino)-N-[3-(trifluoromethyl)phenyl]benzamide Formula: C19H21F3N4OS MolecularWeight: 410.45645

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21F3N4OS/c1-26(2)10-9-23-18(28)25-15-7-3-5-13(11-15)17(27)24-16-8-4-6-14(12-16)19(20,21)22/h3-8,11-12H,9-10H2,1-2H3,(H,24,27)(H2,23,25,28)