2-[(3-chloranyl-4-fluoranyl-phenyl)carbamothioyl-methyl-amino]-N-(4-methylphenyl)ethanamide

Systemtic Name: 2-[(3-chloranyl-4-fluoranyl-phenyl)carbamothioyl-methyl-amino]-N-(4-methylphenyl)ethanamide Openeye Name: 2-[(3-chloro-4-fluoro-phenyl)carbamothioyl-methyl-amino]-N-(p-tolyl)acetamide CAS Name: 2-[[(3-chloro-4-fluoroanilino)-sulfanylidenemethyl]-methylamino]-N-(4-methylphenyl)acetamide IUPAC Name: 2-[(3-chloro-4-fluorophenyl)carbamothioyl-methylamino]-N-(4-methylphenyl)acetamide Traditional Name: 2-[(3-chloro-4-fluoro-phenyl)thiocarbamoyl-methyl-amino]-N-(p-tolyl)acetamide Formula: C17H17ClFN3OS MolecularWeight: 365.852783

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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