4-[[6-(3-cyano-5-methyl-phenyl)carbonyl-2,4-bis(oxidanylidene)-5-propan-2-yl-pyrimidin-1-yl]methyl]pyridine-2-carbonitrile

Systemtic Name: 4-[[6-(3-cyano-5-methyl-phenyl)carbonyl-2,4-bis(oxidanylidene)-5-propan-2-yl-pyrimidin-1-yl]methyl]pyridine-2-carbonitrile Openeye Name: 4-[[6-(3-cyano-5-methyl-benzoyl)-5-isopropyl-2,4-dioxo-pyrimidin-1-yl]methyl]pyridine-2-carbonitrile CAS Name: 4-[[6-[(3-cyano-5-methylphenyl)-oxomethyl]-2,4-dioxo-5-propan-2-yl-1-pyrimidinyl]methyl]-2-pyridinecarbonitrile IUPAC Name: 4-[[6-(3-cyano-5-methylbenzoyl)-2,4-dioxo-5-propan-2-ylpyrimidin-1-yl]methyl]pyridine-2-carbonitrile Traditional Name: 4-[[6-(3-cyano-5-methyl-benzoyl)-5-isopropyl-2,4-diketo-pyrimidin-1-yl]methyl]picolinonitrile Formula: C23H19N5O3 MolecularWeight: 413.42866

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C(=O)C2=C(C(=O)NC(=O)N2CC3=CC(=NC=C3)C#N)C(C)C)C#N

Isomeric SMILES

CC1=CC(=CC(=C1)C(=O)C2=C(C(=O)NC(=O)N2CC3=CC(=NC=C3)C#N)C(C)C)C#N

InChI

InChI=1S/C23H19N5O3/c1-13(2)19-20(21(29)17-7-14(3)6-16(8-17)10-24)28(23(31)27-22(19)30)12-15-4-5-26-18(9-15)11-25/h4-9,13H,12H2,1-3H3,(H,27,30,31)