2-[(3-chloranyl-4-fluoranyl-phenyl)carbamothioylamino]-N-(2,6-dimethylphenyl)ethanamide

Systemtic Name: 2-[(3-chloranyl-4-fluoranyl-phenyl)carbamothioylamino]-N-(2,6-dimethylphenyl)ethanamide Openeye Name: 2-[(3-chloro-4-fluoro-phenyl)carbamothioylamino]-N-(2,6-dimethylphenyl)acetamide CAS Name: 2-[[(3-chloro-4-fluoroanilino)-sulfanylidenemethyl]amino]-N-(2,6-dimethylphenyl)acetamide IUPAC Name: 2-[(3-chloro-4-fluorophenyl)carbamothioylamino]-N-(2,6-dimethylphenyl)acetamide Traditional Name: 2-[(3-chloro-4-fluoro-phenyl)thiocarbamoylamino]-N-(2,6-dimethylphenyl)acetamide Formula: C17H17ClFN3OS MolecularWeight: 365.852783

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)CNC(=S)NC2=CC(=C(C=C2)F)Cl

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)CNC(=S)NC2=CC(=C(C=C2)F)Cl

InChI

InChI=1S/C17H17ClFN3OS/c1-10-4-3-5-11(2)16(10)22-15(23)9-20-17(24)21-12-6-7-14(19)13(18)8-12/h3-8H,9H2,1-2H3,(H,22,23)(H2,20,21,24)