1-[3-[[5-azanyl-6-[(2-ethylphenyl)amino]pyrimidin-4-yl]amino]phenyl]ethanone

Systemtic Name: 1-[3-[[5-azanyl-6-[(2-ethylphenyl)amino]pyrimidin-4-yl]amino]phenyl]ethanone Openeye Name: 1-[3-[[5-amino-6-(2-ethylanilino)pyrimidin-4-yl]amino]phenyl]ethanone CAS Name: 1-[3-[[5-amino-6-(2-ethylanilino)-4-pyrimidinyl]amino]phenyl]ethanone IUPAC Name: 1-[3-[[5-amino-6-(2-ethylanilino)pyrimidin-4-yl]amino]phenyl]ethanone Traditional Name: 1-[3-[[5-amino-6-(2-ethylanilino)pyrimidin-4-yl]amino]phenyl]ethanone Formula: C20H21N5O MolecularWeight: 347.41364

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC2=NC=NC(=C2N)NC3=CC=CC(=C3)C(=O)C

Isomeric SMILES

CCC1=CC=CC=C1NC2=NC=NC(=C2N)NC3=CC=CC(=C3)C(=O)C

InChI

InChI=1S/C20H21N5O/c1-3-14-7-4-5-10-17(14)25-20-18(21)19(22-12-23-20)24-16-9-6-8-15(11-16)13(2)26/h4-12H,3,21H2,1-2H3,(H2,22,23,24,25)