(2S)-2-azanyl-3,3-dimethyl-1-(4-methylsulfonylphenyl)butan-1-one

Systemtic Name: (2S)-2-azanyl-3,3-dimethyl-1-(4-methylsulfonylphenyl)butan-1-one Openeye Name: (2S)-2-amino-3,3-dimethyl-1-(4-methylsulfonylphenyl)butan-1-one CAS Name: (2S)-2-amino-3,3-dimethyl-1-(4-methylsulfonylphenyl)-1-butanone IUPAC Name: (2S)-2-amino-3,3-dimethyl-1-(4-methylsulfonylphenyl)butan-1-one Traditional Name: (2S)-2-amino-1-(4-mesylphenyl)-3,3-dimethyl-butan-1-one Formula: C13H19NO3S MolecularWeight: 269.35986

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(C(=O)C1=CC=C(C=C1)S(=O)(=O)C)N

Isomeric SMILES

CC(C)(C)[C@@H](C(=O)C1=CC=C(C=C1)S(=O)(=O)C)N

InChI

InChI=1S/C13H19NO3S/c1-13(2,3)12(14)11(15)9-5-7-10(8-6-9)18(4,16)17/h5-8,12H,14H2,1-4H3/t12-/m1/s1