(3S)-4-[(5-methoxycarbonyl-1H-pyrazol-3-yl)amino]-3-[[(2S)-2-[[3-[2-[2-(2-methoxyethoxy)ethoxy]ethanoylamino]-1H-pyrazol-5-yl]carbonylamino]propanoyl]amino]-4-oxidanylidene-butanoic acid

Systemtic Name: (3S)-4-[(5-methoxycarbonyl-1H-pyrazol-3-yl)amino]-3-[[(2S)-2-[[3-[2-[2-(2-methoxyethoxy)ethoxy]ethanoylamino]-1H-pyrazol-5-yl]carbonylamino]propanoyl]amino]-4-oxidanylidene-butanoic acid Openeye Name: (3S)-4-[(5-methoxycarbonyl-1H-pyrazol-3-yl)amino]-3-[[(2S)-2-[[3-[[2-[2-(2-methoxyethoxy)ethoxy]acetyl]amino]-1H-pyrazole-5-carbonyl]amino]propanoyl]amino]-4-oxo-butanoic acid CAS Name: (3S)-4-[(5-methoxycarbonyl-1H-pyrazol-3-yl)amino]-3-[[(2S)-2-[[[3-[[2-[2-(2-methoxyethoxy)ethoxy]-1-oxoethyl]amino]-1H-pyrazol-5-yl]-oxomethyl]amino]-1-oxopropyl]amino]-4-oxobutanoic acid IUPAC Name: (3S)-4-[(5-methoxycarbonyl-1H-pyrazol-3-yl)amino]-3-[[(2S)-2-[[3-[[2-[2-(2-methoxyethoxy)ethoxy]acetyl]amino]-1H-pyrazole-5-carbonyl]amino]propanoyl]amino]-4-oxobutanoic acid Traditional Name: (3S)-4-[(5-carbomethoxy-1H-pyrazol-3-yl)amino]-4-keto-3-[[(2S)-2-[[3-[[2-[2-(2-methoxyethoxy)ethoxy]acetyl]amino]-1H-pyrazole-5-carbonyl]amino]propanoyl]amino]butyric acid Formula: C23H32N8O11 MolecularWeight: 596.54718

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(CC(=O)O)C(=O)NC1=NNC(=C1)C(=O)OC)NC(=O)C2=CC(=NN2)NC(=O)COCCOCCOC

Isomeric SMILES

C[C@@H](C(=O)N[C@@H](CC(=O)O)C(=O)NC1=NNC(=C1)C(=O)OC)NC(=O)C2=CC(=NN2)NC(=O)COCCOCCOC

InChI

InChI=1S/C23H32N8O11/c1-12(20(35)25-13(10-19(33)34)21(36)27-17-9-15(29-31-17)23(38)40-3)24-22(37)14-8-16(30-28-14)26-18(32)11-42-7-6-41-5-4-39-2/h8-9,12-13H,4-7,10-11H2,1-3H3,(H,24,37)(H,25,35)(H,33,34)(H2,26,28,30,32)(H2,27,29,31,36)/t12-,13-/m0/s1