3-methyl-2-[[2-[[3-methyl-2-(pyrrolidin-2-ylcarbonylamino)butanoyl]amino]-3-phenyl-propanoyl]amino]butanoic acid

Systemtic Name: 3-methyl-2-[[2-[[3-methyl-2-(pyrrolidin-2-ylcarbonylamino)butanoyl]amino]-3-phenyl-propanoyl]amino]butanoic acid Openeye Name: 3-methyl-2-[[2-[[3-methyl-2-(pyrrolidine-2-carbonylamino)butanoyl]amino]-3-phenyl-propanoyl]amino]butanoic acid CAS Name: 3-methyl-2-[[2-[[3-methyl-1-oxo-2-[[oxo(2-pyrrolidinyl)methyl]amino]butyl]amino]-1-oxo-3-phenylpropyl]amino]butanoic acid IUPAC Name: 3-methyl-2-[[2-[[3-methyl-2-(pyrrolidine-2-carbonylamino)butanoyl]amino]-3-phenylpropanoyl]amino]butanoic acid Traditional Name: 3-methyl-2-[[2-[[3-methyl-2-(prolylamino)butanoyl]amino]-3-phenyl-propanoyl]amino]butyric acid Formula: C24H36N4O5 MolecularWeight: 460.56644

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC(CC1=CC=CC=C1)C(=O)NC(C(C)C)C(=O)O)NC(=O)C2CCCN2

Isomeric SMILES

CC(C)C(C(=O)NC(CC1=CC=CC=C1)C(=O)NC(C(C)C)C(=O)O)NC(=O)C2CCCN2

InChI

InChI=1S/C24H36N4O5/c1-14(2)19(27-21(29)17-11-8-12-25-17)23(31)26-18(13-16-9-6-5-7-10-16)22(30)28-20(15(3)4)24(32)33/h5-7,9-10,14-15,17-20,25H,8,11-13H2,1-4H3,(H,26,31)(H,27,29)(H,28,30)(H,32,33)