(2S)-N-[(2R)-2-cyano-3-methyl-butan-2-yl]-2-(4-pyridin-2-ylpiperazin-1-yl)propanamide

Systemtic Name: (2S)-N-[(2R)-2-cyano-3-methyl-butan-2-yl]-2-(4-pyridin-2-ylpiperazin-1-yl)propanamide Openeye Name: (2S)-N-[(1R)-1-cyano-1,2-dimethyl-propyl]-2-[4-(2-pyridyl)piperazin-1-yl]propanamide CAS Name: (2S)-N-[(2R)-2-cyano-3-methylbutan-2-yl]-2-[4-(2-pyridinyl)-1-piperazinyl]propanamide IUPAC Name: (2S)-N-[(2R)-2-cyano-3-methylbutan-2-yl]-2-(4-pyridin-2-ylpiperazin-1-yl)propanamide Traditional Name: (2S)-N-[(1R)-1-cyano-1,2-dimethyl-propyl]-2-[4-(2-pyridyl)piperazino]propionamide Formula: C18H27N5O MolecularWeight: 329.43988

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C)(C#N)NC(=O)C(C)N1CCN(CC1)C2=CC=CC=N2

Isomeric SMILES

C[C@@H](C(=O)N[C@@](C)(C#N)C(C)C)N1CCN(CC1)C2=CC=CC=N2

InChI

InChI=1S/C18H27N5O/c1-14(2)18(4,13-19)21-17(24)15(3)22-9-11-23(12-10-22)16-7-5-6-8-20-16/h5-8,14-15H,9-12H2,1-4H3,(H,21,24)/t15-,18-/m0/s1