4-(4-methoxyphenyl)-6-(prop-2-enylamino)-2-pyridin-4-yl-pyrimidine-5-carbonitrile

Systemtic Name: 4-(4-methoxyphenyl)-6-(prop-2-enylamino)-2-pyridin-4-yl-pyrimidine-5-carbonitrile Openeye Name: 4-(allylamino)-6-(4-methoxyphenyl)-2-(4-pyridyl)pyrimidine-5-carbonitrile CAS Name: 4-(4-methoxyphenyl)-6-(prop-2-enylamino)-2-pyridin-4-yl-5-pyrimidinecarbonitrile IUPAC Name: 4-(4-methoxyphenyl)-6-(prop-2-enylamino)-2-pyridin-4-ylpyrimidine-5-carbonitrile Traditional Name: 4-(allylamino)-6-(4-methoxyphenyl)-2-(4-pyridyl)pyrimidine-5-carbonitrile Formula: C20H17N5O MolecularWeight: 343.38188

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=C(C(=NC(=N2)C3=CC=NC=C3)NCC=C)C#N

Isomeric SMILES

COC1=CC=C(C=C1)C2=C(C(=NC(=N2)C3=CC=NC=C3)NCC=C)C#N

InChI

InChI=1S/C20H17N5O/c1-3-10-23-20-17(13-21)18(14-4-6-16(26-2)7-5-14)24-19(25-20)15-8-11-22-12-9-15/h3-9,11-12H,1,10H2,2H3,(H,23,24,25)