(phenylmethyl) N-[(2S)-1-(3,5-dimethylpyrazol-1-yl)-1-oxidanylidene-3-phenyl-propan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[(2S)-1-(3,5-dimethylpyrazol-1-yl)-1-oxidanylidene-3-phenyl-propan-2-yl]carbamate Openeye Name: benzyl N-[(1S)-1-benzyl-2-(3,5-dimethylpyrazol-1-yl)-2-oxo-ethyl]carbamate CAS Name: N-[(2S)-1-(3,5-dimethyl-1-pyrazolyl)-1-oxo-3-phenylpropan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[(2S)-1-(3,5-dimethylpyrazol-1-yl)-1-oxo-3-phenylpropan-2-yl]carbamate Traditional Name: N-[(1S)-1-benzyl-2-(3,5-dimethylpyrazol-1-yl)-2-keto-ethyl]carbamic acid benzyl ester Formula: C22H23N3O3 MolecularWeight: 377.43632

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C(=O)C(CC2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=NN1C(=O)[C@H](CC2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3)C

InChI

InChI=1S/C22H23N3O3/c1-16-13-17(2)25(24-16)21(26)20(14-18-9-5-3-6-10-18)23-22(27)28-15-19-11-7-4-8-12-19/h3-13,20H,14-15H2,1-2H3,(H,23,27)/t20-/m0/s1