[2-(2-azanyl-5-quinolin-2-yl-pyrimidin-4-yl)-4-ethyl-5-methoxy-phenyl] ethanoate

Systemtic Name: [2-(2-azanyl-5-quinolin-2-yl-pyrimidin-4-yl)-4-ethyl-5-methoxy-phenyl] ethanoate Openeye Name: [2-[2-amino-5-(2-quinolyl)pyrimidin-4-yl]-4-ethyl-5-methoxy-phenyl] acetate CAS Name: acetic acid [2-[2-amino-5-(2-quinolinyl)-4-pyrimidinyl]-4-ethyl-5-methoxyphenyl] ester IUPAC Name: [2-(2-amino-5-quinolin-2-ylpyrimidin-4-yl)-4-ethyl-5-methoxyphenyl] acetate Traditional Name: acetic acid [2-[2-amino-5-(2-quinolyl)pyrimidin-4-yl]-4-ethyl-5-methoxy-phenyl] ester Formula: C24H22N4O3 MolecularWeight: 414.45648

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C(=C1)C2=NC(=NC=C2C3=NC4=CC=CC=C4C=C3)N)OC(=O)C)OC

Isomeric SMILES

CCC1=C(C=C(C(=C1)C2=NC(=NC=C2C3=NC4=CC=CC=C4C=C3)N)OC(=O)C)OC

InChI

InChI=1S/C24H22N4O3/c1-4-15-11-17(22(31-14(2)29)12-21(15)30-3)23-18(13-26-24(25)28-23)20-10-9-16-7-5-6-8-19(16)27-20/h5-13H,4H2,1-3H3,(H2,25,26,28)