4-(cyclohexylcarbamothioylamino)-N-[(E)-(4-fluorophenyl)methylideneamino]benzamide

Systemtic Name: 4-(cyclohexylcarbamothioylamino)-N-[(E)-(4-fluorophenyl)methylideneamino]benzamide Openeye Name: 4-(cyclohexylcarbamothioylamino)-N-[(E)-(4-fluorophenyl)methyleneamino]benzamide CAS Name: 4-[[(cyclohexylamino)-sulfanylidenemethyl]amino]-N-[(E)-(4-fluorophenyl)methylideneamino]benzamide IUPAC Name: 4-(cyclohexylcarbamothioylamino)-N-[(E)-(4-fluorophenyl)methylideneamino]benzamide Traditional Name: 4-(cyclohexylthiocarbamoylamino)-N-[(E)-(4-fluorobenzylidene)amino]benzamide Formula: C21H23FN4OS MolecularWeight: 398.496923

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=S)NC2=CC=C(C=C2)C(=O)NN=CC3=CC=C(C=C3)F

Isomeric SMILES

C1CCC(CC1)NC(=S)NC2=CC=C(C=C2)C(=O)N/N=C/C3=CC=C(C=C3)F

InChI

InChI=1S/C21H23FN4OS/c22-17-10-6-15(7-11-17)14-23-26-20(27)16-8-12-19(13-9-16)25-21(28)24-18-4-2-1-3-5-18/h6-14,18H,1-5H2,(H,26,27)(H2,24,25,28)/b23-14+