6-(3-cyano-5-methyl-phenyl)carbonyl-2,4-bis(oxidanylidene)-5-propan-2-yl-pyrimidine-1-carbonitrile

Systemtic Name: 6-(3-cyano-5-methyl-phenyl)carbonyl-2,4-bis(oxidanylidene)-5-propan-2-yl-pyrimidine-1-carbonitrile Openeye Name: 6-(3-cyano-5-methyl-benzoyl)-5-isopropyl-2,4-dioxo-pyrimidine-1-carbonitrile CAS Name: 6-[(3-cyano-5-methylphenyl)-oxomethyl]-2,4-dioxo-5-propan-2-yl-1-pyrimidinecarbonitrile IUPAC Name: 6-(3-cyano-5-methylbenzoyl)-2,4-dioxo-5-propan-2-ylpyrimidine-1-carbonitrile Traditional Name: 6-(3-cyano-5-methyl-benzoyl)-5-isopropyl-2,4-diketo-pyrimidine-1-carbonitrile Formula: C17H14N4O3 MolecularWeight: 322.31806

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H14N4O3/c1-9(2)13-14(21(8-19)17(24)20-16(13)23)15(22)12-5-10(3)4-11(6-12)7-18/h4-6,9H,1-3H3,(H,20,23,24)