4-[[[(2S)-2-[(2-fluorophenyl)sulfonylamino]-3-methyl-butanoyl]-methyl-amino]methyl]benzamide

Systemtic Name: 4-[[[(2S)-2-[(2-fluorophenyl)sulfonylamino]-3-methyl-butanoyl]-methyl-amino]methyl]benzamide Openeye Name: 4-[[[(2S)-2-[(2-fluorophenyl)sulfonylamino]-3-methyl-butanoyl]-methyl-amino]methyl]benzamide CAS Name: 4-[[[(2S)-2-[(2-fluorophenyl)sulfonylamino]-3-methyl-1-oxobutyl]-methylamino]methyl]benzamide IUPAC Name: 4-[[[(2S)-2-[(2-fluorophenyl)sulfonylamino]-3-methylbutanoyl]-methylamino]methyl]benzamide Traditional Name: 4-[[[(2S)-2-[(2-fluorophenyl)sulfonylamino]-3-methyl-butanoyl]-methyl-amino]methyl]benzamide Formula: C20H24FN3O4S MolecularWeight: 421.485663

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N(C)CC1=CC=C(C=C1)C(=O)N)NS(=O)(=O)C2=CC=CC=C2F

Isomeric SMILES

CC(C)[C@@H](C(=O)N(C)CC1=CC=C(C=C1)C(=O)N)NS(=O)(=O)C2=CC=CC=C2F

InChI

InChI=1S/C20H24FN3O4S/c1-13(2)18(23-29(27,28)17-7-5-4-6-16(17)21)20(26)24(3)12-14-8-10-15(11-9-14)19(22)25/h4-11,13,18,23H,12H2,1-3H3,(H2,22,25)/t18-/m0/s1