2-[(3-fluoranyl-4-methyl-phenyl)carbamothioylamino]-N-propan-2-yl-ethanamide

Systemtic Name: 2-[(3-fluoranyl-4-methyl-phenyl)carbamothioylamino]-N-propan-2-yl-ethanamide Openeye Name: 2-[(3-fluoro-4-methyl-phenyl)carbamothioylamino]-N-isopropyl-acetamide CAS Name: 2-[[(3-fluoro-4-methylanilino)-sulfanylidenemethyl]amino]-N-propan-2-ylacetamide IUPAC Name: 2-[(3-fluoro-4-methylphenyl)carbamothioylamino]-N-propan-2-ylacetamide Traditional Name: 2-[(3-fluoro-4-methyl-phenyl)thiocarbamoylamino]-N-isopropyl-acetamide Formula: C13H18FN3OS MolecularWeight: 283.364923

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=S)NCC(=O)NC(C)C)F

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=S)NCC(=O)NC(C)C)F

InChI

InChI=1S/C13H18FN3OS/c1-8(2)16-12(18)7-15-13(19)17-10-5-4-9(3)11(14)6-10/h4-6,8H,7H2,1-3H3,(H,16,18)(H2,15,17,19)