2-chloranyl-N-[3-[(4-fluorophenyl)carbonylcarbamothioylamino]phenyl]benzamide

Systemtic Name: 2-chloranyl-N-[3-[(4-fluorophenyl)carbonylcarbamothioylamino]phenyl]benzamide Openeye Name: 2-chloro-N-[3-[(4-fluorobenzoyl)carbamothioylamino]phenyl]benzamide CAS Name: 2-chloro-N-[3-[[[[(4-fluorophenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]phenyl]benzamide IUPAC Name: 2-chloro-N-[3-[(4-fluorobenzoyl)carbamothioylamino]phenyl]benzamide Traditional Name: 2-chloro-N-[3-[(4-fluorobenzoyl)thiocarbamoylamino]phenyl]benzamide Formula: C21H15ClFN3O2S MolecularWeight: 427.879103

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H15ClFN3O2S/c22-18-7-2-1-6-17(18)20(28)24-15-4-3-5-16(12-15)25-21(29)26-19(27)13-8-10-14(23)11-9-13/h1-12H,(H,24,28)(H2,25,26,27,29)