(phenylmethyl) N-[(2S)-1-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methylamino]-3-methyl-1-oxidanylidene-butan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[(2S)-1-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methylamino]-3-methyl-1-oxidanylidene-butan-2-yl]carbamate Openeye Name: benzyl N-[(1S)-1-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methylcarbamoyl]-2-methyl-propyl]carbamate CAS Name: N-[(2S)-1-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)methylamino]-3-methyl-1-oxobutan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[(2S)-1-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methylamino]-3-methyl-1-oxobutan-2-yl]carbamate Traditional Name: N-[(1S)-1-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methylcarbamoyl]-2-methyl-propyl]carbamic acid benzyl ester Formula: C25H30N4O3 MolecularWeight: 434.5307

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)CNC(=O)C(C(C)C)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)CNC(=O)[C@H](C(C)C)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C25H30N4O3/c1-17(2)23(27-25(31)32-16-20-11-7-5-8-12-20)24(30)26-15-22-18(3)28-29(19(22)4)21-13-9-6-10-14-21/h5-14,17,23H,15-16H2,1-4H3,(H,26,30)(H,27,31)/t23-/m0/s1