pentyl 2-[6-[(E)-2-(4-bromophenyl)ethenyl]-2-methyl-4-oxidanylidene-1H-pyrimidin-5-yl]hexanoate

Systemtic Name: pentyl 2-[6-[(E)-2-(4-bromophenyl)ethenyl]-2-methyl-4-oxidanylidene-1H-pyrimidin-5-yl]hexanoate Openeye Name: pentyl 2-[6-[(E)-2-(4-bromophenyl)vinyl]-2-methyl-4-oxo-1H-pyrimidin-5-yl]hexanoate CAS Name: 2-[6-[(E)-2-(4-bromophenyl)ethenyl]-2-methyl-4-oxo-1H-pyrimidin-5-yl]hexanoic acid pentyl ester IUPAC Name: pentyl 2-[6-[(E)-2-(4-bromophenyl)ethenyl]-2-methyl-4-oxo-1H-pyrimidin-5-yl]hexanoate Traditional Name: 2-[6-[(E)-2-(4-bromophenyl)vinyl]-4-keto-2-methyl-1H-pyrimidin-5-yl]hexanoic acid amyl ester Formula: C24H31BrN2O3 MolecularWeight: 475.41854

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)C(CCCC)C1=C(NC(=NC1=O)C)C=CC2=CC=C(C=C2)Br

Isomeric SMILES

CCCCCOC(=O)C(CCCC)C1=C(NC(=NC1=O)C)/C=C/C2=CC=C(C=C2)Br

InChI

InChI=1S/C24H31BrN2O3/c1-4-6-8-16-30-24(29)20(9-7-5-2)22-21(26-17(3)27-23(22)28)15-12-18-10-13-19(25)14-11-18/h10-15,20H,4-9,16H2,1-3H3,(H,26,27,28)/b15-12+