2-fluoranyl-N-[(2S)-4-methyl-1-oxidanylidene-1-(prop-2-ynylamino)hexan-2-yl]benzamide

Systemtic Name: 2-fluoranyl-N-[(2S)-4-methyl-1-oxidanylidene-1-(prop-2-ynylamino)hexan-2-yl]benzamide Openeye Name: 2-fluoro-N-[(1S)-3-methyl-1-(prop-2-ynylcarbamoyl)pentyl]benzamide CAS Name: 2-fluoro-N-[(2S)-4-methyl-1-oxo-1-(prop-2-ynylamino)hexan-2-yl]benzamide IUPAC Name: 2-fluoro-N-[(2S)-4-methyl-1-oxo-1-(prop-2-ynylamino)hexan-2-yl]benzamide Traditional Name: 2-fluoro-N-[(1S)-3-methyl-1-(propargylcarbamoyl)pentyl]benzamide Formula: C17H21FN2O2 MolecularWeight: 304.359243

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CC(C(=O)NCC#C)NC(=O)C1=CC=CC=C1F

Isomeric SMILES

CCC(C)C[C@@H](C(=O)NCC#C)NC(=O)C1=CC=CC=C1F

InChI

InChI=1S/C17H21FN2O2/c1-4-10-19-17(22)15(11-12(3)5-2)20-16(21)13-8-6-7-9-14(13)18/h1,6-9,12,15H,5,10-11H2,2-3H3,(H,19,22)(H,20,21)/t12?,15-/m0/s1