2-azanyl-4-phenylmethoxy-6-(3,4,5-trimethoxyphenyl)pyrimidine-5-carbonitrile

Systemtic Name: 2-azanyl-4-phenylmethoxy-6-(3,4,5-trimethoxyphenyl)pyrimidine-5-carbonitrile Openeye Name: 2-amino-4-benzyloxy-6-(3,4,5-trimethoxyphenyl)pyrimidine-5-carbonitrile CAS Name: 2-amino-4-phenylmethoxy-6-(3,4,5-trimethoxyphenyl)-5-pyrimidinecarbonitrile IUPAC Name: 2-amino-4-phenylmethoxy-6-(3,4,5-trimethoxyphenyl)pyrimidine-5-carbonitrile Traditional Name: 2-amino-4-benzoxy-6-(3,4,5-trimethoxyphenyl)pyrimidine-5-carbonitrile Formula: C21H20N4O4 MolecularWeight: 392.4079

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C2=C(C(=NC(=N2)N)OCC3=CC=CC=C3)C#N

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2=C(C(=NC(=N2)N)OCC3=CC=CC=C3)C#N

InChI

InChI=1S/C21H20N4O4/c1-26-16-9-14(10-17(27-2)19(16)28-3)18-15(11-22)20(25-21(23)24-18)29-12-13-7-5-4-6-8-13/h4-10H,12H2,1-3H3,(H2,23,24,25)