(2S)-N-(4-bromanyl-3-methyl-phenyl)-3-methyl-2-(thiophen-2-ylsulfonylamino)butanamide

Systemtic Name: (2S)-N-(4-bromanyl-3-methyl-phenyl)-3-methyl-2-(thiophen-2-ylsulfonylamino)butanamide Openeye Name: (2S)-N-(4-bromo-3-methyl-phenyl)-3-methyl-2-(2-thienylsulfonylamino)butanamide CAS Name: (2S)-N-(4-bromo-3-methylphenyl)-3-methyl-2-(thiophen-2-ylsulfonylamino)butanamide IUPAC Name: (2S)-N-(4-bromo-3-methylphenyl)-3-methyl-2-(thiophen-2-ylsulfonylamino)butanamide Traditional Name: (2S)-N-(4-bromo-3-methyl-phenyl)-3-methyl-2-(2-thienylsulfonylamino)butyramide Formula: C16H19BrN2O3S2 MolecularWeight: 431.36766

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)C(C(C)C)NS(=O)(=O)C2=CC=CS2)Br

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)[C@H](C(C)C)NS(=O)(=O)C2=CC=CS2)Br

InChI

InChI=1S/C16H19BrN2O3S2/c1-10(2)15(19-24(21,22)14-5-4-8-23-14)16(20)18-12-6-7-13(17)11(3)9-12/h4-10,15,19H,1-3H3,(H,18,20)/t15-/m0/s1