4-[(3-chloranyl-4-fluoranyl-phenyl)carbamothioylamino]-N-(2-diethylaminoethyl)benzamide

Systemtic Name: 4-[(3-chloranyl-4-fluoranyl-phenyl)carbamothioylamino]-N-(2-diethylaminoethyl)benzamide Openeye Name: 4-[(3-chloro-4-fluoro-phenyl)carbamothioylamino]-N-(2-diethylaminoethyl)benzamide CAS Name: 4-[[(3-chloro-4-fluoroanilino)-sulfanylidenemethyl]amino]-N-(2-diethylaminoethyl)benzamide IUPAC Name: 4-[(3-chloro-4-fluorophenyl)carbamothioylamino]-N-(2-diethylaminoethyl)benzamide Traditional Name: 4-[(3-chloro-4-fluoro-phenyl)thiocarbamoylamino]-N-(2-diethylaminoethyl)benzamide Formula: C20H24ClFN4OS MolecularWeight: 422.947163

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCNC(=O)C1=CC=C(C=C1)NC(=S)NC2=CC(=C(C=C2)F)Cl

Isomeric SMILES

CCN(CC)CCNC(=O)C1=CC=C(C=C1)NC(=S)NC2=CC(=C(C=C2)F)Cl

InChI

InChI=1S/C20H24ClFN4OS/c1-3-26(4-2)12-11-23-19(27)14-5-7-15(8-6-14)24-20(28)25-16-9-10-18(22)17(21)13-16/h5-10,13H,3-4,11-12H2,1-2H3,(H,23,27)(H2,24,25,28)