6-[(E)-2-(4-chlorophenyl)prop-1-enyl]-2-methyl-5-(phenylmethyl)-1H-pyrimidin-4-one

Systemtic Name: 6-[(E)-2-(4-chlorophenyl)prop-1-enyl]-2-methyl-5-(phenylmethyl)-1H-pyrimidin-4-one Openeye Name: 5-benzyl-6-[(E)-2-(4-chlorophenyl)prop-1-enyl]-2-methyl-1H-pyrimidin-4-one CAS Name: 6-[(E)-2-(4-chlorophenyl)prop-1-enyl]-2-methyl-5-(phenylmethyl)-1H-pyrimidin-4-one IUPAC Name: 5-benzyl-6-[(E)-2-(4-chlorophenyl)prop-1-enyl]-2-methyl-1H-pyrimidin-4-one Traditional Name: 5-benzyl-6-[(E)-2-(4-chlorophenyl)prop-1-enyl]-2-methyl-1H-pyrimidin-4-one Formula: C21H19ClN2O MolecularWeight: 350.84136

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=O)C(=C(N1)C=C(C)C2=CC=C(C=C2)Cl)CC3=CC=CC=C3

Isomeric SMILES

CC1=NC(=O)C(=C(N1)/C=C(\C)/C2=CC=C(C=C2)Cl)CC3=CC=CC=C3

InChI

InChI=1S/C21H19ClN2O/c1-14(17-8-10-18(22)11-9-17)12-20-19(21(25)24-15(2)23-20)13-16-6-4-3-5-7-16/h3-12H,13H2,1-2H3,(H,23,24,25)/b14-12+