(2S)-2-(4-cyanophenoxy)-N-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]propanamide

Systemtic Name: (2S)-2-(4-cyanophenoxy)-N-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]propanamide Openeye Name: (2S)-2-(4-cyanophenoxy)-N-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]propanamide CAS Name: (2S)-2-(4-cyanophenoxy)-N-[[4-(1-pyrazolylmethyl)phenyl]methyl]propanamide IUPAC Name: (2S)-2-(4-cyanophenoxy)-N-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]propanamide Traditional Name: (2S)-2-(4-cyanophenoxy)-N-[4-(pyrazol-1-ylmethyl)benzyl]propionamide Formula: C21H20N4O2 MolecularWeight: 360.4091

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=C(C=C1)CN2C=CC=N2)OC3=CC=C(C=C3)C#N

Isomeric SMILES

C[C@@H](C(=O)NCC1=CC=C(C=C1)CN2C=CC=N2)OC3=CC=C(C=C3)C#N

InChI

InChI=1S/C21H20N4O2/c1-16(27-20-9-7-17(13-22)8-10-20)21(26)23-14-18-3-5-19(6-4-18)15-25-12-2-11-24-25/h2-12,16H,14-15H2,1H3,(H,23,26)/t16-/m0/s1