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

Systemtic Name: (2S)-2-[(4-bromophenyl)sulfonylamino]-N-[(4-fluorophenyl)methyl]-3-methyl-butanamide Openeye Name: (2S)-2-[(4-bromophenyl)sulfonylamino]-N-[(4-fluorophenyl)methyl]-3-methyl-butanamide CAS Name: (2S)-2-[(4-bromophenyl)sulfonylamino]-N-[(4-fluorophenyl)methyl]-3-methylbutanamide IUPAC Name: (2S)-2-[(4-bromophenyl)sulfonylamino]-N-[(4-fluorophenyl)methyl]-3-methylbutanamide Traditional Name: (2S)-2-(brosylamino)-N-(4-fluorobenzyl)-3-methyl-butyramide Formula: C18H20BrFN2O3S MolecularWeight: 443.330403

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20BrFN2O3S/c1-12(2)17(18(23)21-11-13-3-7-15(20)8-4-13)22-26(24,25)16-9-5-14(19)6-10-16/h3-10,12,17,22H,11H2,1-2H3,(H,21,23)/t17-/m0/s1