pyridin-4-ylmethyl N-[(2S)-1-[(3,3-dimethyl-2-oxidanylidene-butyl)amino]-1-oxidanylidene-3-phenyl-propan-2-yl]carbamate

Systemtic Name: pyridin-4-ylmethyl N-[(2S)-1-[(3,3-dimethyl-2-oxidanylidene-butyl)amino]-1-oxidanylidene-3-phenyl-propan-2-yl]carbamate Openeye Name: 4-pyridylmethyl N-[(1S)-1-benzyl-2-[(3,3-dimethyl-2-oxo-butyl)amino]-2-oxo-ethyl]carbamate CAS Name: N-[(2S)-1-[(3,3-dimethyl-2-oxobutyl)amino]-1-oxo-3-phenylpropan-2-yl]carbamic acid pyridin-4-ylmethyl ester IUPAC Name: pyridin-4-ylmethyl N-[(2S)-1-[(3,3-dimethyl-2-oxobutyl)amino]-1-oxo-3-phenylpropan-2-yl]carbamate Traditional Name: N-[(1S)-1-benzyl-2-keto-2-[(2-keto-3,3-dimethyl-butyl)amino]ethyl]carbamic acid 4-pyridylmethyl ester Formula: C22H27N3O4 MolecularWeight: 397.46748

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27N3O4/c1-22(2,3)19(26)14-24-20(27)18(13-16-7-5-4-6-8-16)25-21(28)29-15-17-9-11-23-12-10-17/h4-12,18H,13-15H2,1-3H3,(H,24,27)(H,25,28)/t18-/m0/s1