5-[[1-azanyl-3-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl]amino]-4-[(2-azanyl-3-methyl-butanoyl)amino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-[[1-azanyl-3-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl]amino]-4-[(2-azanyl-3-methyl-butanoyl)amino]-5-oxidanylidene-pentanoic acid Openeye Name: 5-[[2-amino-1-(1H-indol-3-ylmethyl)-2-oxo-ethyl]amino]-4-[(2-amino-3-methyl-butanoyl)amino]-5-oxo-pentanoic acid CAS Name: 5-[[1-amino-3-(1H-indol-3-yl)-1-oxopropan-2-yl]amino]-4-[(2-amino-3-methyl-1-oxobutyl)amino]-5-oxopentanoic acid IUPAC Name: 5-[[1-amino-3-(1H-indol-3-yl)-1-oxopropan-2-yl]amino]-4-[(2-amino-3-methylbutanoyl)amino]-5-oxopentanoic acid Traditional Name: 5-[[2-amino-1-(1H-indol-3-ylmethyl)-2-keto-ethyl]amino]-4-[(2-amino-3-methyl-butanoyl)amino]-5-keto-valeric acid Formula: C21H29N5O5 MolecularWeight: 431.48546

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H29N5O5/c1-11(2)18(22)21(31)25-15(7-8-17(27)28)20(30)26-16(19(23)29)9-12-10-24-14-6-4-3-5-13(12)14/h3-6,10-11,15-16,18,24H,7-9,22H2,1-2H3,(H2,23,29)(H,25,31)(H,26,30)(H,27,28)