3-[bis(fluoranyl)methyl]-N-[(3-phenoxyphenyl)carbamothioyl]benzamide

Systemtic Name: 3-[bis(fluoranyl)methyl]-N-[(3-phenoxyphenyl)carbamothioyl]benzamide Openeye Name: 3-(difluoromethyl)-N-[(3-phenoxyphenyl)carbamothioyl]benzamide CAS Name: 3-(difluoromethyl)-N-[(3-phenoxyanilino)-sulfanylidenemethyl]benzamide IUPAC Name: 3-(difluoromethyl)-N-[(3-phenoxyphenyl)carbamothioyl]benzamide Traditional Name: 3-(difluoromethyl)-N-[(3-phenoxyphenyl)thiocarbamoyl]benzamide Formula: C21H16F2N2O2S MolecularWeight: 398.425746

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=CC(=C2)NC(=S)NC(=O)C3=CC(=CC=C3)C(F)F

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=CC(=C2)NC(=S)NC(=O)C3=CC(=CC=C3)C(F)F

InChI

InChI=1S/C21H16F2N2O2S/c22-19(23)14-6-4-7-15(12-14)20(26)25-21(28)24-16-8-5-11-18(13-16)27-17-9-2-1-3-10-17/h1-13,19H,(H2,24,25,26,28)