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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)SCCOC2=CC=C(C=C2)OC(C)C)CC3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=O)N=C(N1)SCCOC2=CC=C(C=C2)OC(C)C)CC3=CC=CC=C3

InChI

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