2-[2-[[2-acetamido-3-(1H-indol-3-yl)propanoyl]amino]propanoylamino]-3-methyl-butanamide

Systemtic Name: 2-[2-[[2-acetamido-3-(1H-indol-3-yl)propanoyl]amino]propanoylamino]-3-methyl-butanamide Openeye Name: 2-[2-[[2-acetamido-3-(1H-indol-3-yl)propanoyl]amino]propanoylamino]-3-methyl-butanamide CAS Name: 2-[[2-[[2-acetamido-3-(1H-indol-3-yl)-1-oxopropyl]amino]-1-oxopropyl]amino]-3-methylbutanamide IUPAC Name: 2-[2-[[2-acetamido-3-(1H-indol-3-yl)propanoyl]amino]propanoylamino]-3-methylbutanamide Traditional Name: 2-[2-[[2-acetamido-3-(1H-indol-3-yl)propanoyl]amino]propanoylamino]-3-methyl-butyramide Formula: C21H29N5O4 MolecularWeight: 415.48606

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N)NC(=O)C(C)NC(=O)C(CC1=CNC2=CC=CC=C21)NC(=O)C

Isomeric SMILES

CC(C)C(C(=O)N)NC(=O)C(C)NC(=O)C(CC1=CNC2=CC=CC=C21)NC(=O)C

InChI

InChI=1S/C21H29N5O4/c1-11(2)18(19(22)28)26-20(29)12(3)24-21(30)17(25-13(4)27)9-14-10-23-16-8-6-5-7-15(14)16/h5-8,10-12,17-18,23H,9H2,1-4H3,(H2,22,28)(H,24,30)(H,25,27)(H,26,29)