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

Systemtic Name: 3-methyl-5-[3-methyl-2,6-bis(oxidanylidene)-5-propan-2-yl-pyrimidin-4-yl]carbonyl-benzenecarbonitrile Openeye Name: 3-(5-isopropyl-3-methyl-2,6-dioxo-pyrimidine-4-carbonyl)-5-methyl-benzonitrile CAS Name: 3-methyl-5-[(3-methyl-2,6-dioxo-5-propan-2-yl-4-pyrimidinyl)-oxomethyl]benzonitrile IUPAC Name: 3-methyl-5-(3-methyl-2,6-dioxo-5-propan-2-ylpyrimidine-4-carbonyl)benzonitrile Traditional Name: 3-(5-isopropyl-2,6-diketo-3-methyl-pyrimidine-4-carbonyl)-5-methyl-benzonitrile Formula: C17H17N3O3 MolecularWeight: 311.33518

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C(=O)C2=C(C(=O)NC(=O)N2C)C(C)C)C#N

Isomeric SMILES

CC1=CC(=CC(=C1)C(=O)C2=C(C(=O)NC(=O)N2C)C(C)C)C#N

InChI

InChI=1S/C17H17N3O3/c1-9(2)13-14(20(4)17(23)19-16(13)22)15(21)12-6-10(3)5-11(7-12)8-18/h5-7,9H,1-4H3,(H,19,22,23)