N-[(2S)-1-[[3-(cyclopropylcarbamoyl)phenyl]amino]-3-methyl-1-oxidanylidene-butan-2-yl]-2-fluoranyl-benzamide

Systemtic Name: N-[(2S)-1-[[3-(cyclopropylcarbamoyl)phenyl]amino]-3-methyl-1-oxidanylidene-butan-2-yl]-2-fluoranyl-benzamide Openeye Name: N-[(1S)-1-[[3-(cyclopropylcarbamoyl)phenyl]carbamoyl]-2-methyl-propyl]-2-fluoro-benzamide CAS Name: N-[(2S)-1-[3-[(cyclopropylamino)-oxomethyl]anilino]-3-methyl-1-oxobutan-2-yl]-2-fluorobenzamide IUPAC Name: N-[(2S)-1-[3-(cyclopropylcarbamoyl)anilino]-3-methyl-1-oxobutan-2-yl]-2-fluorobenzamide Traditional Name: N-[(1S)-1-[[3-(cyclopropylcarbamoyl)phenyl]carbamoyl]-2-methyl-propyl]-2-fluoro-benzamide Formula: C22H24FN3O3 MolecularWeight: 397.442663

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1=CC=CC(=C1)C(=O)NC2CC2)NC(=O)C3=CC=CC=C3F

Isomeric SMILES

CC(C)[C@@H](C(=O)NC1=CC=CC(=C1)C(=O)NC2CC2)NC(=O)C3=CC=CC=C3F

InChI

InChI=1S/C22H24FN3O3/c1-13(2)19(26-21(28)17-8-3-4-9-18(17)23)22(29)25-16-7-5-6-14(12-16)20(27)24-15-10-11-15/h3-9,12-13,15,19H,10-11H2,1-2H3,(H,24,27)(H,25,29)(H,26,28)/t19-/m0/s1