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

Systemtic Name: 3-[3-[(Z)-2-chloranylbut-2-enyl]-2,6-bis(oxidanylidene)-5-propan-2-yl-pyrimidin-4-yl]carbonyl-5-methyl-benzenecarbonitrile Openeye Name: 3-[3-[(Z)-2-chlorobut-2-enyl]-5-isopropyl-2,6-dioxo-pyrimidine-4-carbonyl]-5-methyl-benzonitrile CAS Name: 3-[[3-[(Z)-2-chlorobut-2-enyl]-2,6-dioxo-5-propan-2-yl-4-pyrimidinyl]-oxomethyl]-5-methylbenzonitrile IUPAC Name: 3-[3-[(Z)-2-chlorobut-2-enyl]-2,6-dioxo-5-propan-2-ylpyrimidine-4-carbonyl]-5-methylbenzonitrile Traditional Name: 3-[3-[(Z)-2-chlorobut-2-enyl]-5-isopropyl-2,6-diketo-pyrimidine-4-carbonyl]-5-methyl-benzonitrile Formula: C20H20ClN3O3 MolecularWeight: 385.8441

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Descriptors Computed from Structure

Canonical SMILES:

CC=C(CN1C(=C(C(=O)NC1=O)C(C)C)C(=O)C2=CC(=CC(=C2)C#N)C)Cl

Isomeric SMILES

C/C=C(/CN1C(=C(C(=O)NC1=O)C(C)C)C(=O)C2=CC(=CC(=C2)C#N)C)\Cl

InChI

InChI=1S/C20H20ClN3O3/c1-5-15(21)10-24-17(16(11(2)3)19(26)23-20(24)27)18(25)14-7-12(4)6-13(8-14)9-22/h5-8,11H,10H2,1-4H3,(H,23,26,27)/b15-5-