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

Systemtic Name: (phenylmethyl) N-[(2S)-3-methyl-1-oxidanylidene-1-[(1-phenylpyrazol-4-yl)methylamino]butan-2-yl]carbamate Openeye Name: benzyl N-[(1S)-2-methyl-1-[(1-phenylpyrazol-4-yl)methylcarbamoyl]propyl]carbamate CAS Name: N-[(2S)-3-methyl-1-oxo-1-[(1-phenyl-4-pyrazolyl)methylamino]butan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[(2S)-3-methyl-1-oxo-1-[(1-phenylpyrazol-4-yl)methylamino]butan-2-yl]carbamate Traditional Name: N-[(1S)-2-methyl-1-[(1-phenylpyrazol-4-yl)methylcarbamoyl]propyl]carbamic acid benzyl ester Formula: C23H26N4O3 MolecularWeight: 406.47754

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NCC1=CN(N=C1)C2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC(C)[C@@H](C(=O)NCC1=CN(N=C1)C2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C23H26N4O3/c1-17(2)21(26-23(29)30-16-18-9-5-3-6-10-18)22(28)24-13-19-14-25-27(15-19)20-11-7-4-8-12-20/h3-12,14-15,17,21H,13,16H2,1-2H3,(H,24,28)(H,26,29)/t21-/m0/s1