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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC2=C(C(=NC=N2)NC3=CC=CC(=C3)C(=O)C)N

Isomeric SMILES

CCC1=CC=C(C=C1)NC2=C(C(=NC=N2)NC3=CC=CC(=C3)C(=O)C)N

InChI

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