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3-[3-[(5-ethylpyrimidin-2-yl)-(phenylmethyl)amino]propoxy]quinoxaline-2-carboxylic acid
3-[3-[(5-ethylpyrimidin-2-yl)-(phenylmethyl)amino]propoxy]quinoxaline-2-carboxylic acid
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Descriptors Computed from Structure
Canonical SMILES:
CCC1=CN=C(N=C1)N(CCCOC2=NC3=CC=CC=C3N=C2C(=O)O)CC4=CC=CC=C4
Isomeric SMILES
CCC1=CN=C(N=C1)N(CCCOC2=NC3=CC=CC=C3N=C2C(=O)O)CC4=CC=CC=C4
InChI
InChI=1S/C25H25N5O3/c1-2-18-15-26-25(27-16-18)30(17-19-9-4-3-5-10-19)13-8-14-33-23-22(24(31)32)28-20-11-6-7-12-21(20)29-23/h3-7,9-12,15-16H,2,8,13-14,17H2,1H3,(H,31,32)
Other Product
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- 2,4-dimethylpentan-3-yl N-[(3S)-1,2-bis(oxidanylidene)-1-[(2-pyridin-2-ylpyrazol-3-yl)amino]heptan-3-yl]carbamate
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