4-[[4-azanyl-6-(2,6-dimethoxyphenoxy)-1,3,5-triazin-2-yl]amino]benzenecarbonitrile

Systemtic Name: 4-[[4-azanyl-6-(2,6-dimethoxyphenoxy)-1,3,5-triazin-2-yl]amino]benzenecarbonitrile Openeye Name: 4-[[4-amino-6-(2,6-dimethoxyphenoxy)-1,3,5-triazin-2-yl]amino]benzonitrile CAS Name: 4-[[4-amino-6-(2,6-dimethoxyphenoxy)-1,3,5-triazin-2-yl]amino]benzonitrile IUPAC Name: 4-[[4-amino-6-(2,6-dimethoxyphenoxy)-1,3,5-triazin-2-yl]amino]benzonitrile Traditional Name: 4-[[4-amino-6-(2,6-dimethoxyphenoxy)-s-triazin-2-yl]amino]benzonitrile Formula: C18H16N6O3 MolecularWeight: 364.35804

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC=C1)OC)OC2=NC(=NC(=N2)NC3=CC=C(C=C3)C#N)N

Isomeric SMILES

COC1=C(C(=CC=C1)OC)OC2=NC(=NC(=N2)NC3=CC=C(C=C3)C#N)N

InChI

InChI=1S/C18H16N6O3/c1-25-13-4-3-5-14(26-2)15(13)27-18-23-16(20)22-17(24-18)21-12-8-6-11(10-19)7-9-12/h3-9H,1-2H3,(H3,20,21,22,23,24)