methyl 3-(4H-imidazol-4-yl)-2-[2-[[3-methyl-5-[[(2S)-5-oxidanylidenepyrrolidin-2-yl]carbonylamino]pentyl]-(naphthalen-1-ylmethyl)amino]ethanoylamino]propanoate

Systemtic Name: methyl 3-(4H-imidazol-4-yl)-2-[2-[[3-methyl-5-[[(2S)-5-oxidanylidenepyrrolidin-2-yl]carbonylamino]pentyl]-(naphthalen-1-ylmethyl)amino]ethanoylamino]propanoate Openeye Name: methyl 3-(4H-imidazol-4-yl)-2-[[2-[[3-methyl-5-[[(2S)-5-oxopyrrolidine-2-carbonyl]amino]pentyl]-(1-naphthylmethyl)amino]acetyl]amino]propanoate CAS Name: 3-(4H-imidazol-4-yl)-2-[[2-[[3-methyl-5-[[oxo-[(2S)-5-oxo-2-pyrrolidinyl]methyl]amino]pentyl]-(1-naphthalenylmethyl)amino]-1-oxoethyl]amino]propanoic acid methyl ester IUPAC Name: methyl 3-(4H-imidazol-4-yl)-2-[[2-[[3-methyl-5-[[(2S)-5-oxopyrrolidine-2-carbonyl]amino]pentyl]-(naphthalen-1-ylmethyl)amino]acetyl]amino]propanoate Traditional Name: 3-(4H-imidazol-4-yl)-2-[[2-[[5-[[(2S)-5-ketoprolyl]amino]-3-methyl-pentyl]-(1-naphthylmethyl)amino]acetyl]amino]propionic acid methyl ester Formula: C31H40N6O5 MolecularWeight: 576.6865

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCNC(=O)C1CCC(=O)N1)CCN(CC2=CC=CC3=CC=CC=C32)CC(=O)NC(CC4C=NC=N4)C(=O)OC

Isomeric SMILES

CC(CCNC(=O)[C@@H]1CCC(=O)N1)CCN(CC2=CC=CC3=CC=CC=C32)CC(=O)NC(CC4C=NC=N4)C(=O)OC

InChI

InChI=1S/C31H40N6O5/c1-21(12-14-33-30(40)26-10-11-28(38)35-26)13-15-37(18-23-8-5-7-22-6-3-4-9-25(22)23)19-29(39)36-27(31(41)42-2)16-24-17-32-20-34-24/h3-9,17,20-21,24,26-27H,10-16,18-19H2,1-2H3,(H,33,40)(H,35,38)(H,36,39)/t21?,24?,26-,27?/m0/s1