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

Systemtic Name: 4-[[4-azanyl-6-[(2,4-dimethoxyphenyl)methylamino]-1,3,5-triazin-2-yl]amino]benzenecarbonitrile Openeye Name: 4-[[4-amino-6-[(2,4-dimethoxyphenyl)methylamino]-1,3,5-triazin-2-yl]amino]benzonitrile CAS Name: 4-[[4-amino-6-[(2,4-dimethoxyphenyl)methylamino]-1,3,5-triazin-2-yl]amino]benzonitrile IUPAC Name: 4-[[4-amino-6-[(2,4-dimethoxyphenyl)methylamino]-1,3,5-triazin-2-yl]amino]benzonitrile Traditional Name: 4-[[4-amino-6-[(2,4-dimethoxybenzyl)amino]-s-triazin-2-yl]amino]benzonitrile Formula: C19H19N7O2 MolecularWeight: 377.39986

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)CNC2=NC(=NC(=N2)NC3=CC=C(C=C3)C#N)N)OC

Isomeric SMILES

COC1=CC(=C(C=C1)CNC2=NC(=NC(=N2)NC3=CC=C(C=C3)C#N)N)OC

InChI

InChI=1S/C19H19N7O2/c1-27-15-8-5-13(16(9-15)28-2)11-22-18-24-17(21)25-19(26-18)23-14-6-3-12(10-20)4-7-14/h3-9H,11H2,1-2H3,(H4,21,22,23,24,25,26)