3-methyl-5-[3-(4-methylpent-3-enyl)-2,6-bis(oxidanylidene)-5-propan-2-yl-pyrimidin-4-yl]carbonyl-benzenecarbonitrile

Systemtic Name: 3-methyl-5-[3-(4-methylpent-3-enyl)-2,6-bis(oxidanylidene)-5-propan-2-yl-pyrimidin-4-yl]carbonyl-benzenecarbonitrile Openeye Name: 3-[5-isopropyl-3-(4-methylpent-3-enyl)-2,6-dioxo-pyrimidine-4-carbonyl]-5-methyl-benzonitrile CAS Name: 3-methyl-5-[[3-(4-methylpent-3-enyl)-2,6-dioxo-5-propan-2-yl-4-pyrimidinyl]-oxomethyl]benzonitrile IUPAC Name: 3-methyl-5-[3-(4-methylpent-3-enyl)-2,6-dioxo-5-propan-2-ylpyrimidine-4-carbonyl]benzonitrile Traditional Name: 3-[5-isopropyl-2,6-diketo-3-(4-methylpent-3-enyl)pyrimidine-4-carbonyl]-5-methyl-benzonitrile Formula: C22H25N3O3 MolecularWeight: 379.4522

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C(=O)C2=C(C(=O)NC(=O)N2CCC=C(C)C)C(C)C)C#N

Isomeric SMILES

CC1=CC(=CC(=C1)C(=O)C2=C(C(=O)NC(=O)N2CCC=C(C)C)C(C)C)C#N

InChI

InChI=1S/C22H25N3O3/c1-13(2)7-6-8-25-19(18(14(3)4)21(27)24-22(25)28)20(26)17-10-15(5)9-16(11-17)12-23/h7,9-11,14H,6,8H2,1-5H3,(H,24,27,28)