4-[[[4-[2,4-bis(azanyl)-6-ethyl-pyrimidin-5-yl]phenyl]amino]methyl]benzenecarbonitrile

Systemtic Name: 4-[[[4-[2,4-bis(azanyl)-6-ethyl-pyrimidin-5-yl]phenyl]amino]methyl]benzenecarbonitrile Openeye Name: 4-[[4-(2,4-diamino-6-ethyl-pyrimidin-5-yl)anilino]methyl]benzonitrile CAS Name: 4-[[4-(2,4-diamino-6-ethyl-5-pyrimidinyl)anilino]methyl]benzonitrile IUPAC Name: 4-[[4-(2,4-diamino-6-ethylpyrimidin-5-yl)anilino]methyl]benzonitrile Traditional Name: 4-[[4-(2,4-diamino-6-ethyl-pyrimidin-5-yl)anilino]methyl]benzonitrile Formula: C20H20N6 MolecularWeight: 344.413

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NC(=N1)N)N)C2=CC=C(C=C2)NCC3=CC=C(C=C3)C#N

Isomeric SMILES

CCC1=C(C(=NC(=N1)N)N)C2=CC=C(C=C2)NCC3=CC=C(C=C3)C#N

InChI

InChI=1S/C20H20N6/c1-2-17-18(19(22)26-20(23)25-17)15-7-9-16(10-8-15)24-12-14-5-3-13(11-21)4-6-14/h3-10,24H,2,12H2,1H3,(H4,22,23,25,26)