(2S)-N-[(1,5-dimethylpyrrol-2-yl)methyl]-3-methyl-2-(2-phenylethanoylamino)butanamide

Systemtic Name: (2S)-N-[(1,5-dimethylpyrrol-2-yl)methyl]-3-methyl-2-(2-phenylethanoylamino)butanamide Openeye Name: (2S)-N-[(1,5-dimethylpyrrol-2-yl)methyl]-3-methyl-2-[(2-phenylacetyl)amino]butanamide CAS Name: (2S)-N-[(1,5-dimethyl-2-pyrrolyl)methyl]-3-methyl-2-[(1-oxo-2-phenylethyl)amino]butanamide IUPAC Name: (2S)-N-[(1,5-dimethylpyrrol-2-yl)methyl]-3-methyl-2-[(2-phenylacetyl)amino]butanamide Traditional Name: (2S)-N-[(1,5-dimethylpyrrol-2-yl)methyl]-3-methyl-2-[(2-phenylacetyl)amino]butyramide Formula: C20H27N3O2 MolecularWeight: 341.44728

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1C)CNC(=O)C(C(C)C)NC(=O)CC2=CC=CC=C2

Isomeric SMILES

CC1=CC=C(N1C)CNC(=O)[C@H](C(C)C)NC(=O)CC2=CC=CC=C2

InChI

InChI=1S/C20H27N3O2/c1-14(2)19(22-18(24)12-16-8-6-5-7-9-16)20(25)21-13-17-11-10-15(3)23(17)4/h5-11,14,19H,12-13H2,1-4H3,(H,21,25)(H,22,24)/t19-/m0/s1