3-[5-[2-[7-methoxy-2-[(4-methylpyridin-3-yl)amino]-1,3-benzoxazol-6-yl]ethanoylamino]pyridin-2-yl]butanoic acid

Systemtic Name: 3-[5-[2-[7-methoxy-2-[(4-methylpyridin-3-yl)amino]-1,3-benzoxazol-6-yl]ethanoylamino]pyridin-2-yl]butanoic acid Openeye Name: 3-[5-[[2-[7-methoxy-2-[(4-methyl-3-pyridyl)amino]-1,3-benzoxazol-6-yl]acetyl]amino]-2-pyridyl]butanoic acid CAS Name: 3-[5-[[2-[7-methoxy-2-[(4-methyl-3-pyridinyl)amino]-1,3-benzoxazol-6-yl]-1-oxoethyl]amino]-2-pyridinyl]butanoic acid IUPAC Name: 3-[5-[[2-[7-methoxy-2-[(4-methylpyridin-3-yl)amino]-1,3-benzoxazol-6-yl]acetyl]amino]pyridin-2-yl]butanoic acid Traditional Name: 3-[5-[[2-[7-methoxy-2-[(4-methyl-3-pyridyl)amino]-1,3-benzoxazol-6-yl]acetyl]amino]-2-pyridyl]butyric acid Formula: C25H25N5O5 MolecularWeight: 475.4965

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NC=C1)NC2=NC3=C(O2)C(=C(C=C3)CC(=O)NC4=CN=C(C=C4)C(C)CC(=O)O)OC

Isomeric SMILES

CC1=C(C=NC=C1)NC2=NC3=C(O2)C(=C(C=C3)CC(=O)NC4=CN=C(C=C4)C(C)CC(=O)O)OC

InChI

InChI=1S/C25H25N5O5/c1-14-8-9-26-13-20(14)30-25-29-19-6-4-16(23(34-3)24(19)35-25)11-21(31)28-17-5-7-18(27-12-17)15(2)10-22(32)33/h4-9,12-13,15H,10-11H2,1-3H3,(H,28,31)(H,29,30)(H,32,33)