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

Systemtic Name: (2S)-2-[(4-bromophenyl)sulfonylamino]-N-[(3-methoxyphenyl)methyl]-3-methyl-butanamide Openeye Name: (2S)-2-[(4-bromophenyl)sulfonylamino]-N-[(3-methoxyphenyl)methyl]-3-methyl-butanamide CAS Name: (2S)-2-[(4-bromophenyl)sulfonylamino]-N-[(3-methoxyphenyl)methyl]-3-methylbutanamide IUPAC Name: (2S)-2-[(4-bromophenyl)sulfonylamino]-N-[(3-methoxyphenyl)methyl]-3-methylbutanamide Traditional Name: (2S)-2-(brosylamino)-N-m-anisyl-3-methyl-butyramide Formula: C19H23BrN2O4S MolecularWeight: 455.36592

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NCC1=CC(=CC=C1)OC)NS(=O)(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

CC(C)[C@@H](C(=O)NCC1=CC(=CC=C1)OC)NS(=O)(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C19H23BrN2O4S/c1-13(2)18(22-27(24,25)17-9-7-15(20)8-10-17)19(23)21-12-14-5-4-6-16(11-14)26-3/h4-11,13,18,22H,12H2,1-3H3,(H,21,23)/t18-/m0/s1