2-[2-[2-[(4-fluorophenyl)amino]-2-oxidanylidene-ethyl]sulfinylethanoyl-phenyl-amino]-3,3-dimethyl-butanamide

Systemtic Name: 2-[2-[2-[(4-fluorophenyl)amino]-2-oxidanylidene-ethyl]sulfinylethanoyl-phenyl-amino]-3,3-dimethyl-butanamide Openeye Name: 2-(N-[2-[2-(4-fluoroanilino)-2-oxo-ethyl]sulfinylacetyl]anilino)-3,3-dimethyl-butanamide CAS Name: 2-(N-[2-[2-(4-fluoroanilino)-2-oxoethyl]sulfinyl-1-oxoethyl]anilino)-3,3-dimethylbutanamide IUPAC Name: 2-(N-[2-[2-(4-fluoroanilino)-2-oxoethyl]sulfinylacetyl]anilino)-3,3-dimethylbutanamide Traditional Name: 2-(N-[2-[2-(4-fluoroanilino)-2-keto-ethyl]sulfinylacetyl]anilino)-3,3-dimethyl-butyramide Formula: C22H26FN3O4S MolecularWeight: 447.522943

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(C(=O)N)N(C1=CC=CC=C1)C(=O)CS(=O)CC(=O)NC2=CC=C(C=C2)F

Isomeric SMILES

CC(C)(C)C(C(=O)N)N(C1=CC=CC=C1)C(=O)CS(=O)CC(=O)NC2=CC=C(C=C2)F

InChI

InChI=1S/C22H26FN3O4S/c1-22(2,3)20(21(24)29)26(17-7-5-4-6-8-17)19(28)14-31(30)13-18(27)25-16-11-9-15(23)10-12-16/h4-12,20H,13-14H2,1-3H3,(H2,24,29)(H,25,27)