3-[[1-methyl-2-oxidanylidene-6-(3-phenylprop-1-ynyl)-4H-pyrido[2,3-d]pyrimidin-3-yl]methyl]benzenecarbonitrile

Systemtic Name: 3-[[1-methyl-2-oxidanylidene-6-(3-phenylprop-1-ynyl)-4H-pyrido[2,3-d]pyrimidin-3-yl]methyl]benzenecarbonitrile Openeye Name: 3-[[1-methyl-2-oxo-6-(3-phenylprop-1-ynyl)-4H-pyrido[2,3-d]pyrimidin-3-yl]methyl]benzonitrile CAS Name: 3-[[1-methyl-2-oxo-6-(3-phenylprop-1-ynyl)-4H-pyrido[2,3-d]pyrimidin-3-yl]methyl]benzonitrile IUPAC Name: 3-[[1-methyl-2-oxo-6-(3-phenylprop-1-ynyl)-4H-pyrido[2,3-d]pyrimidin-3-yl]methyl]benzonitrile Traditional Name: 3-[[2-keto-1-methyl-6-(3-phenylprop-1-ynyl)-4H-pyrido[2,3-d]pyrimidin-3-yl]methyl]benzonitrile Formula: C25H20N4O MolecularWeight: 392.4525

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(CN(C1=O)CC3=CC=CC(=C3)C#N)C=C(C=N2)C#CCC4=CC=CC=C4

Isomeric SMILES

CN1C2=C(CN(C1=O)CC3=CC=CC(=C3)C#N)C=C(C=N2)C#CCC4=CC=CC=C4

InChI

InChI=1S/C25H20N4O/c1-28-24-23(14-21(16-27-24)11-5-9-19-7-3-2-4-8-19)18-29(25(28)30)17-22-12-6-10-20(13-22)15-26/h2-4,6-8,10,12-14,16H,9,17-18H2,1H3