(2S)-4-methyl-2-[[(2S)-3-methyl-2-(methylamino)butanoyl]amino]-N-phenyl-pentanamide

Systemtic Name: (2S)-4-methyl-2-[[(2S)-3-methyl-2-(methylamino)butanoyl]amino]-N-phenyl-pentanamide Openeye Name: (2S)-4-methyl-2-[[(2S)-3-methyl-2-(methylamino)butanoyl]amino]-N-phenyl-pentanamide CAS Name: (2S)-4-methyl-2-[[(2S)-3-methyl-2-(methylamino)-1-oxobutyl]amino]-N-phenylpentanamide IUPAC Name: (2S)-4-methyl-2-[[(2S)-3-methyl-2-(methylamino)butanoyl]amino]-N-phenylpentanamide Traditional Name: (2S)-4-methyl-2-[[(2S)-3-methyl-2-(methylamino)butanoyl]amino]-N-phenyl-valeramide Formula: C18H29N3O2 MolecularWeight: 325.398443

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC1=CC=CC=C1)NC(=O)C(C(C)C)NC

Isomeric SMILES

CC(C)C[C@@H](C(=O)NC1=CC=CC=C1)N[13C](=O)[13C@H]([13CH]([13CH3])[13CH3])[15NH]C

InChI

InChI=1S/C18H29N3O2/c1-12(2)11-15(21-18(23)16(19-5)13(3)4)17(22)20-14-9-7-6-8-10-14/h6-10,12-13,15-16,19H,11H2,1-5H3,(H,20,22)(H,21,23)/t15-,16-/m0/s1/i3+1,4+1,13+1,16+1,18+1,19+1