2-[1-(2-azanyl-6-methyl-pyrimidin-4-yl)-2-methyl-indol-3-yl]ethanoic acid

Systemtic Name: 2-[1-(2-azanyl-6-methyl-pyrimidin-4-yl)-2-methyl-indol-3-yl]ethanoic acid Openeye Name: 2-[1-(2-amino-6-methyl-pyrimidin-4-yl)-2-methyl-indol-3-yl]acetic acid CAS Name: 2-[1-(2-amino-6-methyl-4-pyrimidinyl)-2-methyl-3-indolyl]acetic acid IUPAC Name: 2-[1-(2-amino-6-methylpyrimidin-4-yl)-2-methylindol-3-yl]acetic acid Traditional Name: 2-[1-(2-amino-6-methyl-pyrimidin-4-yl)-2-methyl-indol-3-yl]acetic acid Formula: C16H16N4O2 MolecularWeight: 296.32384

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N)N2C(=C(C3=CC=CC=C32)CC(=O)O)C

Isomeric SMILES

CC1=CC(=NC(=N1)N)N2C(=C(C3=CC=CC=C32)CC(=O)O)C

InChI

InChI=1S/C16H16N4O2/c1-9-7-14(19-16(17)18-9)20-10(2)12(8-15(21)22)11-5-3-4-6-13(11)20/h3-7H,8H2,1-2H3,(H,21,22)(H2,17,18,19)