N-butan-2-yl-3-[(4-fluorophenyl)carbonylcarbamothioylamino]benzamide

Systemtic Name: N-butan-2-yl-3-[(4-fluorophenyl)carbonylcarbamothioylamino]benzamide Openeye Name: 3-[(4-fluorobenzoyl)carbamothioylamino]-N-sec-butyl-benzamide CAS Name: N-butan-2-yl-3-[[[[(4-fluorophenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]benzamide IUPAC Name: N-butan-2-yl-3-[(4-fluorobenzoyl)carbamothioylamino]benzamide Traditional Name: 3-[(4-fluorobenzoyl)thiocarbamoylamino]-N-sec-butyl-benzamide Formula: C19H20FN3O2S MolecularWeight: 373.444403

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1=CC(=CC=C1)NC(=S)NC(=O)C2=CC=C(C=C2)F

Isomeric SMILES

CCC(C)NC(=O)C1=CC(=CC=C1)NC(=S)NC(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C19H20FN3O2S/c1-3-12(2)21-18(25)14-5-4-6-16(11-14)22-19(26)23-17(24)13-7-9-15(20)10-8-13/h4-12H,3H2,1-2H3,(H,21,25)(H2,22,23,24,26)