6-methyl-5-(phenylmethyl)-2-[2-(4-propoxyphenoxy)ethylsulfanyl]-1H-pyrimidin-4-one

Systemtic Name: 6-methyl-5-(phenylmethyl)-2-[2-(4-propoxyphenoxy)ethylsulfanyl]-1H-pyrimidin-4-one Openeye Name: 5-benzyl-6-methyl-2-[2-(4-propoxyphenoxy)ethylsulfanyl]-1H-pyrimidin-4-one CAS Name: 6-methyl-5-(phenylmethyl)-2-[2-(4-propoxyphenoxy)ethylthio]-1H-pyrimidin-4-one IUPAC Name: 5-benzyl-6-methyl-2-[2-(4-propoxyphenoxy)ethylsulfanyl]-1H-pyrimidin-4-one Traditional Name: 5-benzyl-6-methyl-2-[2-(4-propoxyphenoxy)ethylthio]-1H-pyrimidin-4-one Formula: C23H26N2O3S MolecularWeight: 410.52914

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)OCCSC2=NC(=O)C(=C(N2)C)CC3=CC=CC=C3

Isomeric SMILES

CCCOC1=CC=C(C=C1)OCCSC2=NC(=O)C(=C(N2)C)CC3=CC=CC=C3

InChI

InChI=1S/C23H26N2O3S/c1-3-13-27-19-9-11-20(12-10-19)28-14-15-29-23-24-17(2)21(22(26)25-23)16-18-7-5-4-6-8-18/h4-12H,3,13-16H2,1-2H3,(H,24,25,26)