6-[2-(3,4-dimethoxyphenyl)ethylamino]-2-methyl-4-oxidanylidene-1H-pyrimidine-5-carbonitrile

Systemtic Name: 6-[2-(3,4-dimethoxyphenyl)ethylamino]-2-methyl-4-oxidanylidene-1H-pyrimidine-5-carbonitrile Openeye Name: 6-[2-(3,4-dimethoxyphenyl)ethylamino]-2-methyl-4-oxo-1H-pyrimidine-5-carbonitrile CAS Name: 6-[2-(3,4-dimethoxyphenyl)ethylamino]-2-methyl-4-oxo-1H-pyrimidine-5-carbonitrile IUPAC Name: 6-[2-(3,4-dimethoxyphenyl)ethylamino]-2-methyl-4-oxo-1H-pyrimidine-5-carbonitrile Traditional Name: 6-(homoveratrylamino)-4-keto-2-methyl-1H-pyrimidine-5-carbonitrile Formula: C16H18N4O3 MolecularWeight: 314.33912

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=O)C(=C(N1)NCCC2=CC(=C(C=C2)OC)OC)C#N

Isomeric SMILES

CC1=NC(=O)C(=C(N1)NCCC2=CC(=C(C=C2)OC)OC)C#N

InChI

InChI=1S/C16H18N4O3/c1-10-19-15(12(9-17)16(21)20-10)18-7-6-11-4-5-13(22-2)14(8-11)23-3/h4-5,8H,6-7H2,1-3H3,(H2,18,19,20,21)