(2S)-2-[(3-cyclopentyl-1-phenyl-pyrazol-4-yl)methylamino]-4-methyl-pentanoic acid

Systemtic Name: (2S)-2-[(3-cyclopentyl-1-phenyl-pyrazol-4-yl)methylamino]-4-methyl-pentanoic acid Openeye Name: (2S)-2-[(3-cyclopentyl-1-phenyl-pyrazol-4-yl)methylamino]-4-methyl-pentanoic acid CAS Name: (2S)-2-[(3-cyclopentyl-1-phenyl-4-pyrazolyl)methylamino]-4-methylpentanoic acid IUPAC Name: (2S)-2-[(3-cyclopentyl-1-phenylpyrazol-4-yl)methylamino]-4-methylpentanoic acid Traditional Name: (2S)-2-[(3-cyclopentyl-1-phenyl-pyrazol-4-yl)methylamino]-4-methyl-valeric acid Formula: C21H24N3O2 MolecularWeight: 350.43416

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)NCC1=CN(N=C1[C]2[CH][CH][CH][CH]2)C3=CC=CC=C3

Isomeric SMILES

CC(C)C[C@@H](C(=O)O)NCC1=CN(N=C1[C]2[CH][CH][CH][CH]2)C3=CC=CC=C3

InChI

InChI=1S/C21H24N3O2/c1-15(2)12-19(21(25)26)22-13-17-14-24(18-10-4-3-5-11-18)23-20(17)16-8-6-7-9-16/h3-11,14-15,19,22H,12-13H2,1-2H3,(H,25,26)/t19-/m0/s1