methyl 3-acetamido-2-[[(3S)-3-ethyl-1-[[(2S)-1-[2-(1H-imidazol-5-yl)ethanoyl]pyrrolidin-2-yl]methyl]pyrrolidin-2-yl]carbonylamino]propanoate

Systemtic Name: methyl 3-acetamido-2-[[(3S)-3-ethyl-1-[[(2S)-1-[2-(1H-imidazol-5-yl)ethanoyl]pyrrolidin-2-yl]methyl]pyrrolidin-2-yl]carbonylamino]propanoate Openeye Name: methyl 3-acetamido-2-[[(3S)-3-ethyl-1-[[(2S)-1-[2-(1H-imidazol-5-yl)acetyl]pyrrolidin-2-yl]methyl]pyrrolidine-2-carbonyl]amino]propanoate CAS Name: 3-acetamido-2-[[[(3S)-3-ethyl-1-[[(2S)-1-[2-(1H-imidazol-5-yl)-1-oxoethyl]-2-pyrrolidinyl]methyl]-2-pyrrolidinyl]-oxomethyl]amino]propanoic acid methyl ester IUPAC Name: methyl 3-acetamido-2-[[(3S)-3-ethyl-1-[[(2S)-1-[2-(1H-imidazol-5-yl)acetyl]pyrrolidin-2-yl]methyl]pyrrolidine-2-carbonyl]amino]propanoate Traditional Name: 3-acetamido-2-[[(3S)-3-ethyl-1-[[(2S)-1-[2-(1H-imidazol-5-yl)acetyl]pyrrolidin-2-yl]methyl]prolyl]amino]propionic acid methyl ester Formula: C23H36N6O5 MolecularWeight: 476.56914

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCN(C1C(=O)NC(CNC(=O)C)C(=O)OC)CC2CCCN2C(=O)CC3=CN=CN3

Isomeric SMILES

CC[C@H]1CCN(C1C(=O)NC(CNC(=O)C)C(=O)OC)C[C@@H]2CCCN2C(=O)CC3=CN=CN3

InChI

InChI=1S/C23H36N6O5/c1-4-16-7-9-28(21(16)22(32)27-19(23(33)34-3)12-25-15(2)30)13-18-6-5-8-29(18)20(31)10-17-11-24-14-26-17/h11,14,16,18-19,21H,4-10,12-13H2,1-3H3,(H,24,26)(H,25,30)(H,27,32)/t16-,18-,19?,21?/m0/s1