N-(3-chloranyl-4-fluoranyl-phenyl)-3-(2,2-dimethylpropanoylcarbamothioylamino)benzamide

Systemtic Name: N-(3-chloranyl-4-fluoranyl-phenyl)-3-(2,2-dimethylpropanoylcarbamothioylamino)benzamide Openeye Name: N-(3-chloro-4-fluoro-phenyl)-3-(2,2-dimethylpropanoylcarbamothioylamino)benzamide CAS Name: N-(3-chloro-4-fluorophenyl)-3-[[[(2,2-dimethyl-1-oxopropyl)amino]-sulfanylidenemethyl]amino]benzamide IUPAC Name: N-(3-chloro-4-fluorophenyl)-3-(2,2-dimethylpropanoylcarbamothioylamino)benzamide Traditional Name: N-(3-chloro-4-fluoro-phenyl)-3-(pivaloylthiocarbamoylamino)benzamide Formula: C19H19ClFN3O2S MolecularWeight: 407.889463

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H19ClFN3O2S/c1-19(2,3)17(26)24-18(27)23-12-6-4-5-11(9-12)16(25)22-13-7-8-15(21)14(20)10-13/h4-10H,1-3H3,(H,22,25)(H2,23,24,26,27)