N-[(1S)-1-cyano-1-cyclopropyl-ethyl]-2-[[(S)-(4-methylphenyl)-phenyl-methyl]amino]ethanamide

Systemtic Name: N-[(1S)-1-cyano-1-cyclopropyl-ethyl]-2-[[(S)-(4-methylphenyl)-phenyl-methyl]amino]ethanamide Openeye Name: N-[(1S)-1-cyano-1-cyclopropyl-ethyl]-2-[[(S)-phenyl(p-tolyl)methyl]amino]acetamide CAS Name: N-[(1S)-1-cyano-1-cyclopropylethyl]-2-[[(S)-(4-methylphenyl)-phenylmethyl]amino]acetamide IUPAC Name: N-[(1S)-1-cyano-1-cyclopropylethyl]-2-[[(S)-(4-methylphenyl)-phenylmethyl]amino]acetamide Traditional Name: N-[(1S)-1-cyano-1-cyclopropyl-ethyl]-2-[[(S)-phenyl(p-tolyl)methyl]amino]acetamide Formula: C22H25N3O MolecularWeight: 347.4534

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C2=CC=CC=C2)NCC(=O)NC(C)(C#N)C3CC3

Isomeric SMILES

CC1=CC=C(C=C1)[C@H](C2=CC=CC=C2)NCC(=O)N[C@](C)(C#N)C3CC3

InChI

InChI=1S/C22H25N3O/c1-16-8-10-18(11-9-16)21(17-6-4-3-5-7-17)24-14-20(26)25-22(2,15-23)19-12-13-19/h3-11,19,21,24H,12-14H2,1-2H3,(H,25,26)/t21-,22+/m0/s1