2-[[2-[[1-[6-azanyl-2-[[2-(2-azanylethanoylamino)-3-(4H-imidazol-4-yl)propanoyl]amino]hexanoyl]pyrrolidin-2-yl]carbonylamino]-3-phenyl-propanoyl]amino]-3-methyl-butanoic acid

Systemtic Name: 2-[[2-[[1-[6-azanyl-2-[[2-(2-azanylethanoylamino)-3-(4H-imidazol-4-yl)propanoyl]amino]hexanoyl]pyrrolidin-2-yl]carbonylamino]-3-phenyl-propanoyl]amino]-3-methyl-butanoic acid Openeye Name: 2-[[2-[[1-[6-amino-2-[[2-[(2-aminoacetyl)amino]-3-(4H-imidazol-4-yl)propanoyl]amino]hexanoyl]pyrrolidine-2-carbonyl]amino]-3-phenyl-propanoyl]amino]-3-methyl-butanoic acid CAS Name: 2-[[2-[[[1-[6-amino-2-[[2-[(2-amino-1-oxoethyl)amino]-3-(4H-imidazol-4-yl)-1-oxopropyl]amino]-1-oxohexyl]-2-pyrrolidinyl]-oxomethyl]amino]-1-oxo-3-phenylpropyl]amino]-3-methylbutanoic acid IUPAC Name: 2-[[2-[[1-[6-amino-2-[[2-[(2-aminoacetyl)amino]-3-(4H-imidazol-4-yl)propanoyl]amino]hexanoyl]pyrrolidine-2-carbonyl]amino]-3-phenylpropanoyl]amino]-3-methylbutanoic acid Traditional Name: 2-[[2-[[1-[6-amino-2-[[2-(glycylamino)-3-(4H-imidazol-4-yl)propanoyl]amino]hexanoyl]prolyl]amino]-3-phenyl-propanoyl]amino]-3-methyl-butyric acid Formula: C33H49N9O7 MolecularWeight: 683.79826

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NC(=O)C(CC1=CC=CC=C1)NC(=O)C2CCCN2C(=O)C(CCCCN)NC(=O)C(CC3C=NC=N3)NC(=O)CN

Isomeric SMILES

CC(C)C(C(=O)O)NC(=O)C(CC1=CC=CC=C1)NC(=O)C2CCCN2C(=O)C(CCCCN)NC(=O)C(CC3C=NC=N3)NC(=O)CN

InChI

InChI=1S/C33H49N9O7/c1-20(2)28(33(48)49)41-30(45)24(15-21-9-4-3-5-10-21)40-31(46)26-12-8-14-42(26)32(47)23(11-6-7-13-34)39-29(44)25(38-27(43)17-35)16-22-18-36-19-37-22/h3-5,9-10,18-20,22-26,28H,6-8,11-17,34-35H2,1-2H3,(H,38,43)(H,39,44)(H,40,46)(H,41,45)(H,48,49)