(2R)-1-[2-[[(2S)-2-[[(2S)-2-[[(2S)-2-acetamido-3-methyl-butanoyl]amino]-3-(1H-imidazol-5-yl)propanoyl]amino]propanoyl]amino]ethanoyl]-N-[(1R)-2-[[(2S)-1-azanyl-1-oxidanylidene-propan-2-yl]amino]-2-oxidanylidene-1-phenyl-ethyl]pyrrolidine-2-carboxamide

Systemtic Name: (2R)-1-[2-[[(2S)-2-[[(2S)-2-[[(2S)-2-acetamido-3-methyl-butanoyl]amino]-3-(1H-imidazol-5-yl)propanoyl]amino]propanoyl]amino]ethanoyl]-N-[(1R)-2-[[(2S)-1-azanyl-1-oxidanylidene-propan-2-yl]amino]-2-oxidanylidene-1-phenyl-ethyl]pyrrolidine-2-carboxamide Openeye Name: (2R)-1-[2-[[(2S)-2-[[(2S)-2-[[(2S)-2-acetamido-3-methyl-butanoyl]amino]-3-(1H-imidazol-5-yl)propanoyl]amino]propanoyl]amino]acetyl]-N-[(1R)-2-[[(1S)-2-amino-1-methyl-2-oxo-ethyl]amino]-2-oxo-1-phenyl-ethyl]pyrrolidine-2-carboxamide CAS Name: (2R)-1-[2-[[(2S)-2-[[(2S)-2-[[(2S)-2-acetamido-3-methyl-1-oxobutyl]amino]-3-(1H-imidazol-5-yl)-1-oxopropyl]amino]-1-oxopropyl]amino]-1-oxoethyl]-N-[(1R)-2-[[(2S)-1-amino-1-oxopropan-2-yl]amino]-2-oxo-1-phenylethyl]-2-pyrrolidinecarboxamide IUPAC Name: (2R)-1-[2-[[(2S)-2-[[(2S)-2-[[(2S)-2-acetamido-3-methylbutanoyl]amino]-3-(1H-imidazol-5-yl)propanoyl]amino]propanoyl]amino]acetyl]-N-[(1R)-2-[[(2S)-1-amino-1-oxopropan-2-yl]amino]-2-oxo-1-phenylethyl]pyrrolidine-2-carboxamide Traditional Name: (2R)-1-[2-[[(2S)-2-[[(2S)-2-[[(2S)-2-acetamido-3-methyl-butanoyl]amino]-3-(1H-imidazol-5-yl)propanoyl]amino]propanoyl]amino]acetyl]-N-[(1R)-2-[[(1S)-2-amino-2-keto-1-methyl-ethyl]amino]-2-keto-1-phenyl-ethyl]pyrrolidine-2-carboxamide Formula: C34H48N10O8 MolecularWeight: 724.80712

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC(CC1=CN=CN1)C(=O)NC(C)C(=O)NCC(=O)N2CCCC2C(=O)NC(C3=CC=CC=C3)C(=O)NC(C)C(=O)N)NC(=O)C

Isomeric SMILES

C[C@@H](C(=O)N)NC(=O)[C@@H](C1=CC=CC=C1)NC(=O)[C@H]2CCCN2C(=O)CNC(=O)[C@H](C)NC(=O)[C@H](CC3=CN=CN3)NC(=O)[C@H](C(C)C)NC(=O)C

InChI

InChI=1S/C34H48N10O8/c1-18(2)27(41-21(5)45)33(51)42-24(14-23-15-36-17-38-23)31(49)40-20(4)30(48)37-16-26(46)44-13-9-12-25(44)32(50)43-28(22-10-7-6-8-11-22)34(52)39-19(3)29(35)47/h6-8,10-11,15,17-20,24-25,27-28H,9,12-14,16H2,1-5H3,(H2,35,47)(H,36,38)(H,37,48)(H,39,52)(H,40,49)(H,41,45)(H,42,51)(H,43,50)/t19-,20-,24-,25+,27-,28+/m0/s1