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

Systemtic Name: N-[4-[(4-butylsulfanyl-3-chloranyl-phenyl)carbamothioylamino]phenyl]-2-fluoranyl-benzamide Openeye Name: N-[4-[(4-butylsulfanyl-3-chloro-phenyl)carbamothioylamino]phenyl]-2-fluoro-benzamide CAS Name: N-[4-[[[4-(butylthio)-3-chloroanilino]-sulfanylidenemethyl]amino]phenyl]-2-fluorobenzamide IUPAC Name: N-[4-[(4-butylsulfanyl-3-chlorophenyl)carbamothioylamino]phenyl]-2-fluorobenzamide Traditional Name: N-[4-[[4-(butylthio)-3-chloro-phenyl]thiocarbamoylamino]phenyl]-2-fluoro-benzamide Formula: C24H23ClFN3OS2 MolecularWeight: 488.040323

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=C(C=C(C=C1)NC(=S)NC2=CC=C(C=C2)NC(=O)C3=CC=CC=C3F)Cl

Isomeric SMILES

CCCCSC1=C(C=C(C=C1)NC(=S)NC2=CC=C(C=C2)NC(=O)C3=CC=CC=C3F)Cl

InChI

InChI=1S/C24H23ClFN3OS2/c1-2-3-14-32-22-13-12-18(15-20(22)25)29-24(31)28-17-10-8-16(9-11-17)27-23(30)19-6-4-5-7-21(19)26/h4-13,15H,2-3,14H2,1H3,(H,27,30)(H2,28,29,31)