2-[5-[3-[ethyl-(5-methylpyrimidin-2-yl)amino]propoxy]-1H-indol-3-yl]ethanoic acid

Systemtic Name: 2-[5-[3-[ethyl-(5-methylpyrimidin-2-yl)amino]propoxy]-1H-indol-3-yl]ethanoic acid Openeye Name: 2-[5-[3-[ethyl-(5-methylpyrimidin-2-yl)amino]propoxy]-1H-indol-3-yl]acetic acid CAS Name: 2-[5-[3-[ethyl-(5-methyl-2-pyrimidinyl)amino]propoxy]-1H-indol-3-yl]acetic acid IUPAC Name: 2-[5-[3-[ethyl-(5-methylpyrimidin-2-yl)amino]propoxy]-1H-indol-3-yl]acetic acid Traditional Name: 2-[5-[3-[ethyl-(5-methylpyrimidin-2-yl)amino]propoxy]-1H-indol-3-yl]acetic acid Formula: C20H24N4O3 MolecularWeight: 368.42956

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCCOC1=CC2=C(C=C1)NC=C2CC(=O)O)C3=NC=C(C=N3)C

Isomeric SMILES

CCN(CCCOC1=CC2=C(C=C1)NC=C2CC(=O)O)C3=NC=C(C=N3)C

InChI

InChI=1S/C20H24N4O3/c1-3-24(20-22-11-14(2)12-23-20)7-4-8-27-16-5-6-18-17(10-16)15(13-21-18)9-19(25)26/h5-6,10-13,21H,3-4,7-9H2,1-2H3,(H,25,26)