2-[(3-chloranyl-4-fluoranyl-phenyl)carbamothioylamino]-N-cyclopropyl-ethanamide

Systemtic Name: 2-[(3-chloranyl-4-fluoranyl-phenyl)carbamothioylamino]-N-cyclopropyl-ethanamide Openeye Name: 2-[(3-chloro-4-fluoro-phenyl)carbamothioylamino]-N-cyclopropyl-acetamide CAS Name: 2-[[(3-chloro-4-fluoroanilino)-sulfanylidenemethyl]amino]-N-cyclopropylacetamide IUPAC Name: 2-[(3-chloro-4-fluorophenyl)carbamothioylamino]-N-cyclopropylacetamide Traditional Name: 2-[(3-chloro-4-fluoro-phenyl)thiocarbamoylamino]-N-cyclopropyl-acetamide Formula: C12H13ClFN3OS MolecularWeight: 301.767523

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)CNC(=S)NC2=CC(=C(C=C2)F)Cl

Isomeric SMILES

C1CC1NC(=O)CNC(=S)NC2=CC(=C(C=C2)F)Cl

InChI

InChI=1S/C12H13ClFN3OS/c13-9-5-8(3-4-10(9)14)17-12(19)15-6-11(18)16-7-1-2-7/h3-5,7H,1-2,6H2,(H,16,18)(H2,15,17,19)