(3S)-3-[[(2S)-3-methyl-2-(2-naphthalen-1-yloxyethanoylamino)butanoyl]amino]-4-oxidanylidene-5-pyrimidin-4-yloxy-pentanoic acid

Systemtic Name: (3S)-3-[[(2S)-3-methyl-2-(2-naphthalen-1-yloxyethanoylamino)butanoyl]amino]-4-oxidanylidene-5-pyrimidin-4-yloxy-pentanoic acid Openeye Name: (3S)-3-[[(2S)-3-methyl-2-[[2-(1-naphthyloxy)acetyl]amino]butanoyl]amino]-4-oxo-5-pyrimidin-4-yloxy-pentanoic acid CAS Name: (3S)-3-[[(2S)-3-methyl-2-[[2-(1-naphthalenyloxy)-1-oxoethyl]amino]-1-oxobutyl]amino]-4-oxo-5-(4-pyrimidinyloxy)pentanoic acid IUPAC Name: (3S)-3-[[(2S)-3-methyl-2-[(2-naphthalen-1-yloxyacetyl)amino]butanoyl]amino]-4-oxo-5-pyrimidin-4-yloxypentanoic acid Traditional Name: (3S)-4-keto-3-[[(2S)-3-methyl-2-[[2-(1-naphthoxy)acetyl]amino]butanoyl]amino]-5-(4-pyrimidyloxy)valeric acid Formula: C26H28N4O7 MolecularWeight: 508.52312

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC(CC(=O)O)C(=O)COC1=NC=NC=C1)NC(=O)COC2=CC=CC3=CC=CC=C32

Isomeric SMILES

CC(C)[C@@H](C(=O)N[C@@H](CC(=O)O)C(=O)COC1=NC=NC=C1)NC(=O)COC2=CC=CC3=CC=CC=C32

InChI

InChI=1S/C26H28N4O7/c1-16(2)25(30-22(32)14-36-21-9-5-7-17-6-3-4-8-18(17)21)26(35)29-19(12-24(33)34)20(31)13-37-23-10-11-27-15-28-23/h3-11,15-16,19,25H,12-14H2,1-2H3,(H,29,35)(H,30,32)(H,33,34)/t19-,25-/m0/s1