N-[(1S)-1-cyano-1-cyclopropyl-ethyl]-2-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl-methyl-amino]ethanamide

Systemtic Name: N-[(1S)-1-cyano-1-cyclopropyl-ethyl]-2-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl-methyl-amino]ethanamide Openeye Name: N-[(1S)-1-cyano-1-cyclopropyl-ethyl]-2-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl-methyl-amino]acetamide CAS Name: N-[(1S)-1-cyano-1-cyclopropylethyl]-2-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)methyl-methylamino]acetamide IUPAC Name: N-[(1S)-1-cyano-1-cyclopropylethyl]-2-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methyl-methylamino]acetamide Traditional Name: N-[(1S)-1-cyano-1-cyclopropyl-ethyl]-2-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl-methyl-amino]acetamide Formula: C21H27N5O MolecularWeight: 365.47198

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)CN(C)CC(=O)NC(C)(C#N)C3CC3

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)CN(C)CC(=O)N[C@](C)(C#N)C3CC3

InChI

InChI=1S/C21H27N5O/c1-15-19(16(2)26(24-15)18-8-6-5-7-9-18)12-25(4)13-20(27)23-21(3,14-22)17-10-11-17/h5-9,17H,10-13H2,1-4H3,(H,23,27)/t21-/m1/s1