(2S)-N-(cyanomethyl)-2-(2,2-diphenylethanoylamino)-3-(5-methylpyridin-3-yl)propanamide

Systemtic Name: (2S)-N-(cyanomethyl)-2-(2,2-diphenylethanoylamino)-3-(5-methylpyridin-3-yl)propanamide Openeye Name: (2S)-N-(cyanomethyl)-2-[(2,2-diphenylacetyl)amino]-3-(5-methyl-3-pyridyl)propanamide CAS Name: (2S)-N-(cyanomethyl)-3-(5-methyl-3-pyridinyl)-2-[(1-oxo-2,2-diphenylethyl)amino]propanamide IUPAC Name: (2S)-N-(cyanomethyl)-2-[(2,2-diphenylacetyl)amino]-3-(5-methylpyridin-3-yl)propanamide Traditional Name: (2S)-N-(cyanomethyl)-2-[(2,2-diphenylacetyl)amino]-3-(5-methyl-3-pyridyl)propionamide Formula: C25H24N4O2 MolecularWeight: 412.48366

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CN=C1)CC(C(=O)NCC#N)NC(=O)C(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CC1=CC(=CN=C1)C[C@@H](C(=O)NCC#N)NC(=O)C(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C25H24N4O2/c1-18-14-19(17-27-16-18)15-22(24(30)28-13-12-26)29-25(31)23(20-8-4-2-5-9-20)21-10-6-3-7-11-21/h2-11,14,16-17,22-23H,13,15H2,1H3,(H,28,30)(H,29,31)/t22-/m0/s1