(2S)-2-[(4-bromophenyl)sulfonylamino]-3-methyl-N-[(3-methylthiophen-2-yl)methyl]butanamide

Systemtic Name: (2S)-2-[(4-bromophenyl)sulfonylamino]-3-methyl-N-[(3-methylthiophen-2-yl)methyl]butanamide Openeye Name: (2S)-2-[(4-bromophenyl)sulfonylamino]-3-methyl-N-[(3-methyl-2-thienyl)methyl]butanamide CAS Name: (2S)-2-[(4-bromophenyl)sulfonylamino]-3-methyl-N-[(3-methyl-2-thiophenyl)methyl]butanamide IUPAC Name: (2S)-2-[(4-bromophenyl)sulfonylamino]-3-methyl-N-[(3-methylthiophen-2-yl)methyl]butanamide Traditional Name: (2S)-2-(brosylamino)-3-methyl-N-[(3-methyl-2-thienyl)methyl]butyramide Formula: C17H21BrN2O3S2 MolecularWeight: 445.39424

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)CNC(=O)C(C(C)C)NS(=O)(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

CC1=C(SC=C1)CNC(=O)[C@H](C(C)C)NS(=O)(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C17H21BrN2O3S2/c1-11(2)16(17(21)19-10-15-12(3)8-9-24-15)20-25(22,23)14-6-4-13(18)5-7-14/h4-9,11,16,20H,10H2,1-3H3,(H,19,21)/t16-/m0/s1