N-(2,6-dimethylphenyl)-4-[1-[(2-fluorophenyl)amino]-1-oxidanylidene-propan-2-yl]sulfanyl-butanamide

Systemtic Name: N-(2,6-dimethylphenyl)-4-[1-[(2-fluorophenyl)amino]-1-oxidanylidene-propan-2-yl]sulfanyl-butanamide Openeye Name: N-(2,6-dimethylphenyl)-4-[2-(2-fluoroanilino)-1-methyl-2-oxo-ethyl]sulfanyl-butanamide CAS Name: N-(2,6-dimethylphenyl)-4-[[1-(2-fluoroanilino)-1-oxopropan-2-yl]thio]butanamide IUPAC Name: N-(2,6-dimethylphenyl)-4-[1-(2-fluoroanilino)-1-oxopropan-2-yl]sulfanylbutanamide Traditional Name: N-(2,6-dimethylphenyl)-4-[[2-(2-fluoroanilino)-2-keto-1-methyl-ethyl]thio]butyramide Formula: C21H25FN2O2S MolecularWeight: 388.498803

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)CCCSC(C)C(=O)NC2=CC=CC=C2F

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)CCCSC(C)C(=O)NC2=CC=CC=C2F

InChI

InChI=1S/C21H25FN2O2S/c1-14-8-6-9-15(2)20(14)24-19(25)12-7-13-27-16(3)21(26)23-18-11-5-4-10-17(18)22/h4-6,8-11,16H,7,12-13H2,1-3H3,(H,23,26)(H,24,25)