N-(3-chloranyl-4-fluoranyl-phenyl)-3-[(3-ethoxyphenyl)carbonylcarbamothioylamino]benzamide

Systemtic Name: N-(3-chloranyl-4-fluoranyl-phenyl)-3-[(3-ethoxyphenyl)carbonylcarbamothioylamino]benzamide Openeye Name: N-(3-chloro-4-fluoro-phenyl)-3-[(3-ethoxybenzoyl)carbamothioylamino]benzamide CAS Name: N-(3-chloro-4-fluorophenyl)-3-[[[[(3-ethoxyphenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]benzamide IUPAC Name: N-(3-chloro-4-fluorophenyl)-3-[(3-ethoxybenzoyl)carbamothioylamino]benzamide Traditional Name: N-(3-chloro-4-fluoro-phenyl)-3-[(3-ethoxybenzoyl)thiocarbamoylamino]benzamide Formula: C23H19ClFN3O3S MolecularWeight: 471.931663

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=CC(=C2)C(=O)NC3=CC(=C(C=C3)F)Cl

Isomeric SMILES

CCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=CC(=C2)C(=O)NC3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C23H19ClFN3O3S/c1-2-31-18-8-4-6-15(12-18)22(30)28-23(32)27-16-7-3-5-14(11-16)21(29)26-17-9-10-20(25)19(24)13-17/h3-13H,2H2,1H3,(H,26,29)(H2,27,28,30,32)