2-[(2-ethyl-5-prop-1-en-2-yl-phenyl)methylsulfanyl]-4-oxidanyl-5-(phenylmethyl)-1H-pyrimidin-6-one

Systemtic Name: 2-[(2-ethyl-5-prop-1-en-2-yl-phenyl)methylsulfanyl]-4-oxidanyl-5-(phenylmethyl)-1H-pyrimidin-6-one Openeye Name: 5-benzyl-2-[(2-ethyl-5-isopropenyl-phenyl)methylsulfanyl]-4-hydroxy-1H-pyrimidin-6-one CAS Name: 2-[[2-ethyl-5-(1-methylethenyl)phenyl]methylthio]-4-hydroxy-5-(phenylmethyl)-1H-pyrimidin-6-one IUPAC Name: 5-benzyl-2-[(2-ethyl-5-prop-1-en-2-ylphenyl)methylsulfanyl]-4-hydroxy-1H-pyrimidin-6-one Traditional Name: 5-benzyl-2-[(2-ethyl-5-isopropenyl-benzyl)thio]-4-hydroxy-1H-pyrimidin-6-one Formula: C23H24N2O2S MolecularWeight: 392.51386

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C=C1)C(=C)C)CSC2=NC(=C(C(=O)N2)CC3=CC=CC=C3)O

Isomeric SMILES

CCC1=C(C=C(C=C1)C(=C)C)CSC2=NC(=C(C(=O)N2)CC3=CC=CC=C3)O

InChI

InChI=1S/C23H24N2O2S/c1-4-17-10-11-18(15(2)3)13-19(17)14-28-23-24-21(26)20(22(27)25-23)12-16-8-6-5-7-9-16/h5-11,13H,2,4,12,14H2,1,3H3,(H2,24,25,26,27)