2-chloranyl-N-cyclohexyl-5-[(4-fluorophenyl)carbonylcarbamothioylamino]benzamide

Systemtic Name: 2-chloranyl-N-cyclohexyl-5-[(4-fluorophenyl)carbonylcarbamothioylamino]benzamide Openeye Name: 2-chloro-N-cyclohexyl-5-[(4-fluorobenzoyl)carbamothioylamino]benzamide CAS Name: 2-chloro-N-cyclohexyl-5-[[[[(4-fluorophenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]benzamide IUPAC Name: 2-chloro-N-cyclohexyl-5-[(4-fluorobenzoyl)carbamothioylamino]benzamide Traditional Name: 2-chloro-N-cyclohexyl-5-[(4-fluorobenzoyl)thiocarbamoylamino]benzamide Formula: C21H21ClFN3O2S MolecularWeight: 433.926743

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)C2=C(C=CC(=C2)NC(=S)NC(=O)C3=CC=C(C=C3)F)Cl

Isomeric SMILES

C1CCC(CC1)NC(=O)C2=C(C=CC(=C2)NC(=S)NC(=O)C3=CC=C(C=C3)F)Cl

InChI

InChI=1S/C21H21ClFN3O2S/c22-18-11-10-16(12-17(18)20(28)24-15-4-2-1-3-5-15)25-21(29)26-19(27)13-6-8-14(23)9-7-13/h6-12,15H,1-5H2,(H,24,28)(H2,25,26,27,29)