(phenylmethyl) N-[(2S)-1-[(4-fluoranyl-3-methyl-phenyl)methylamino]-3-methyl-1-oxidanylidene-butan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[(2S)-1-[(4-fluoranyl-3-methyl-phenyl)methylamino]-3-methyl-1-oxidanylidene-butan-2-yl]carbamate Openeye Name: benzyl N-[(1S)-1-[(4-fluoro-3-methyl-phenyl)methylcarbamoyl]-2-methyl-propyl]carbamate CAS Name: N-[(2S)-1-[(4-fluoro-3-methylphenyl)methylamino]-3-methyl-1-oxobutan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[(2S)-1-[(4-fluoro-3-methylphenyl)methylamino]-3-methyl-1-oxobutan-2-yl]carbamate Traditional Name: N-[(1S)-1-[(4-fluoro-3-methyl-benzyl)carbamoyl]-2-methyl-propyl]carbamic acid benzyl ester Formula: C21H25FN2O3 MolecularWeight: 372.433203

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)CNC(=O)C(C(C)C)NC(=O)OCC2=CC=CC=C2)F

Isomeric SMILES

CC1=C(C=CC(=C1)CNC(=O)[C@H](C(C)C)NC(=O)OCC2=CC=CC=C2)F

InChI

InChI=1S/C21H25FN2O3/c1-14(2)19(24-21(26)27-13-16-7-5-4-6-8-16)20(25)23-12-17-9-10-18(22)15(3)11-17/h4-11,14,19H,12-13H2,1-3H3,(H,23,25)(H,24,26)/t19-/m0/s1