4-azanyl-2-[(Z)-1-cyano-2-(3,4-dimethoxyphenyl)ethenyl]-6-(cyanomethyl)pyrimidine-5-carbonitrile

Systemtic Name: 4-azanyl-2-[(Z)-1-cyano-2-(3,4-dimethoxyphenyl)ethenyl]-6-(cyanomethyl)pyrimidine-5-carbonitrile Openeye Name: 4-amino-2-[(Z)-1-cyano-2-(3,4-dimethoxyphenyl)vinyl]-6-(cyanomethyl)pyrimidine-5-carbonitrile CAS Name: 4-amino-2-[(Z)-1-cyano-2-(3,4-dimethoxyphenyl)ethenyl]-6-(cyanomethyl)-5-pyrimidinecarbonitrile IUPAC Name: 4-amino-2-[(Z)-1-cyano-2-(3,4-dimethoxyphenyl)ethenyl]-6-(cyanomethyl)pyrimidine-5-carbonitrile Traditional Name: 4-amino-2-[(Z)-1-cyano-2-(3,4-dimethoxyphenyl)vinyl]-6-(cyanomethyl)pyrimidine-5-carbonitrile Formula: C18H14N6O2 MolecularWeight: 346.34276

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=C(C#N)C2=NC(=C(C(=N2)N)C#N)CC#N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)/C=C(/C#N)\C2=NC(=C(C(=N2)N)C#N)CC#N)OC

InChI

InChI=1S/C18H14N6O2/c1-25-15-4-3-11(8-16(15)26-2)7-12(9-20)18-23-14(5-6-19)13(10-21)17(22)24-18/h3-4,7-8H,5H2,1-2H3,(H2,22,23,24)/b12-7-