N-(3-chloranyl-4-fluoranyl-phenyl)-3-(pentanoylcarbamothioylamino)benzamide

Systemtic Name: N-(3-chloranyl-4-fluoranyl-phenyl)-3-(pentanoylcarbamothioylamino)benzamide Openeye Name: N-(3-chloro-4-fluoro-phenyl)-3-(pentanoylcarbamothioylamino)benzamide CAS Name: N-(3-chloro-4-fluorophenyl)-3-[[(1-oxopentylamino)-sulfanylidenemethyl]amino]benzamide IUPAC Name: N-(3-chloro-4-fluorophenyl)-3-(pentanoylcarbamothioylamino)benzamide Traditional Name: N-(3-chloro-4-fluoro-phenyl)-3-(valerylthiocarbamoylamino)benzamide Formula: C19H19ClFN3O2S MolecularWeight: 407.889463

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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