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

Systemtic Name: N-(3-chloranyl-4-fluoranyl-phenyl)-3-[(3-propoxyphenyl)carbonylcarbamothioylamino]benzamide Openeye Name: N-(3-chloro-4-fluoro-phenyl)-3-[(3-propoxybenzoyl)carbamothioylamino]benzamide CAS Name: N-(3-chloro-4-fluorophenyl)-3-[[[[oxo-(3-propoxyphenyl)methyl]amino]-sulfanylidenemethyl]amino]benzamide IUPAC Name: N-(3-chloro-4-fluorophenyl)-3-[(3-propoxybenzoyl)carbamothioylamino]benzamide Traditional Name: N-(3-chloro-4-fluoro-phenyl)-3-[(3-propoxybenzoyl)thiocarbamoylamino]benzamide Formula: C24H21ClFN3O3S MolecularWeight: 485.958243

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=CC(=C2)C(=O)NC3=CC(=C(C=C3)F)Cl

Isomeric SMILES

CCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=CC(=C2)C(=O)NC3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C24H21ClFN3O3S/c1-2-11-32-19-8-4-6-16(13-19)23(31)29-24(33)28-17-7-3-5-15(12-17)22(30)27-18-9-10-21(26)20(25)14-18/h3-10,12-14H,2,11H2,1H3,(H,27,30)(H2,28,29,31,33)