(phenylmethyl) N-[(2S)-1-[(4,6-dimethyl-2-oxidanylidene-1H-pyridin-3-yl)methylamino]-3-methyl-1-oxidanylidene-butan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[(2S)-1-[(4,6-dimethyl-2-oxidanylidene-1H-pyridin-3-yl)methylamino]-3-methyl-1-oxidanylidene-butan-2-yl]carbamate Openeye Name: benzyl N-[(1S)-1-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methylcarbamoyl]-2-methyl-propyl]carbamate CAS Name: N-[(2S)-1-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methylamino]-3-methyl-1-oxobutan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[(2S)-1-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methylamino]-3-methyl-1-oxobutan-2-yl]carbamate Traditional Name: N-[(1S)-1-[(2-keto-4,6-dimethyl-1H-pyridin-3-yl)methylcarbamoyl]-2-methyl-propyl]carbamic acid benzyl ester Formula: C21H27N3O4 MolecularWeight: 385.45678

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=O)N1)CNC(=O)C(C(C)C)NC(=O)OCC2=CC=CC=C2)C

Isomeric SMILES

CC1=CC(=C(C(=O)N1)CNC(=O)[C@H](C(C)C)NC(=O)OCC2=CC=CC=C2)C

InChI

InChI=1S/C21H27N3O4/c1-13(2)18(24-21(27)28-12-16-8-6-5-7-9-16)20(26)22-11-17-14(3)10-15(4)23-19(17)25/h5-10,13,18H,11-12H2,1-4H3,(H,22,26)(H,23,25)(H,24,27)/t18-/m0/s1