(2S)-3-methyl-2-(2-phenylethanoylamino)-N-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]butanamide

Systemtic Name: (2S)-3-methyl-2-(2-phenylethanoylamino)-N-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]butanamide Openeye Name: (2S)-3-methyl-2-[(2-phenylacetyl)amino]-N-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]butanamide CAS Name: (2S)-3-methyl-2-[(1-oxo-2-phenylethyl)amino]-N-[[2-(1-pyrrolidinylmethyl)phenyl]methyl]butanamide IUPAC Name: (2S)-3-methyl-2-[(2-phenylacetyl)amino]-N-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]butanamide Traditional Name: (2S)-3-methyl-2-[(2-phenylacetyl)amino]-N-[2-(pyrrolidinomethyl)benzyl]butyramide Formula: C25H33N3O2 MolecularWeight: 407.54842

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NCC1=CC=CC=C1CN2CCCC2)NC(=O)CC3=CC=CC=C3

Isomeric SMILES

CC(C)[C@@H](C(=O)NCC1=CC=CC=C1CN2CCCC2)NC(=O)CC3=CC=CC=C3

InChI

InChI=1S/C25H33N3O2/c1-19(2)24(27-23(29)16-20-10-4-3-5-11-20)25(30)26-17-21-12-6-7-13-22(21)18-28-14-8-9-15-28/h3-7,10-13,19,24H,8-9,14-18H2,1-2H3,(H,26,30)(H,27,29)/t24-/m0/s1