6-methyl-2-[3-(2-prop-2-enylphenoxy)propylsulfanyl]pyrimidin-4-olate

Systemtic Name: 6-methyl-2-[3-(2-prop-2-enylphenoxy)propylsulfanyl]pyrimidin-4-olate Openeye Name: 2-[3-(2-allylphenoxy)propylsulfanyl]-6-methyl-pyrimidin-4-olate CAS Name: 6-methyl-2-[3-(2-prop-2-enylphenoxy)propylthio]-4-pyrimidinolate IUPAC Name: 6-methyl-2-[3-(2-prop-2-enylphenoxy)propylsulfanyl]pyrimidin-4-olate Traditional Name: 2-[3-(2-allylphenoxy)propylthio]-6-methyl-pyrimidin-4-olate Formula: C17H19N2O2S- MolecularWeight: 315.40996

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCCCOC2=CC=CC=C2CC=C)[O-]

Isomeric SMILES

CC1=CC(=NC(=N1)SCCCOC2=CC=CC=C2CC=C)[O-]

InChI

InChI=1S/C17H20N2O2S/c1-3-7-14-8-4-5-9-15(14)21-10-6-11-22-17-18-13(2)12-16(20)19-17/h3-5,8-9,12H,1,6-7,10-11H2,2H3,(H,18,19,20)/p-1