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

Systemtic Name: (2S)-N-[(3-acetamidophenyl)methyl]-2-[(2-fluorophenyl)sulfonylamino]-3-methyl-butanamide Openeye Name: (2S)-N-[(3-acetamidophenyl)methyl]-2-[(2-fluorophenyl)sulfonylamino]-3-methyl-butanamide CAS Name: (2S)-N-[(3-acetamidophenyl)methyl]-2-[(2-fluorophenyl)sulfonylamino]-3-methylbutanamide IUPAC Name: (2S)-N-[(3-acetamidophenyl)methyl]-2-[(2-fluorophenyl)sulfonylamino]-3-methylbutanamide Traditional Name: (2S)-N-(3-acetamidobenzyl)-2-[(2-fluorophenyl)sulfonylamino]-3-methyl-butyramide Formula: C20H24FN3O4S MolecularWeight: 421.485663

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NCC1=CC(=CC=C1)NC(=O)C)NS(=O)(=O)C2=CC=CC=C2F

Isomeric SMILES

CC(C)[C@@H](C(=O)NCC1=CC(=CC=C1)NC(=O)C)NS(=O)(=O)C2=CC=CC=C2F

InChI

InChI=1S/C20H24FN3O4S/c1-13(2)19(24-29(27,28)18-10-5-4-9-17(18)21)20(26)22-12-15-7-6-8-16(11-15)23-14(3)25/h4-11,13,19,24H,12H2,1-3H3,(H,22,26)(H,23,25)/t19-/m0/s1