(2S)-N-(4-butylphenyl)-2-[(2-fluorophenyl)sulfonylamino]-4-methylsulfanyl-butanamide

Systemtic Name: (2S)-N-(4-butylphenyl)-2-[(2-fluorophenyl)sulfonylamino]-4-methylsulfanyl-butanamide Openeye Name: (2S)-N-(4-butylphenyl)-2-[(2-fluorophenyl)sulfonylamino]-4-methylsulfanyl-butanamide CAS Name: (2S)-N-(4-butylphenyl)-2-[(2-fluorophenyl)sulfonylamino]-4-(methylthio)butanamide IUPAC Name: (2S)-N-(4-butylphenyl)-2-[(2-fluorophenyl)sulfonylamino]-4-methylsulfanylbutanamide Traditional Name: (2S)-N-(4-butylphenyl)-2-[(2-fluorophenyl)sulfonylamino]-4-(methylthio)butyramide Formula: C21H27FN2O3S2 MolecularWeight: 438.579083

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)C(CCSC)NS(=O)(=O)C2=CC=CC=C2F

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)[C@H](CCSC)NS(=O)(=O)C2=CC=CC=C2F

InChI

InChI=1S/C21H27FN2O3S2/c1-3-4-7-16-10-12-17(13-11-16)23-21(25)19(14-15-28-2)24-29(26,27)20-9-6-5-8-18(20)22/h5-6,8-13,19,24H,3-4,7,14-15H2,1-2H3,(H,23,25)/t19-/m0/s1