6-methyl-2-[2-[2-(2-phenylphenoxy)ethoxy]ethylsulfanyl]pyrimidin-4-olate

Systemtic Name: 6-methyl-2-[2-[2-(2-phenylphenoxy)ethoxy]ethylsulfanyl]pyrimidin-4-olate Openeye Name: 6-methyl-2-[2-[2-(2-phenylphenoxy)ethoxy]ethylsulfanyl]pyrimidin-4-olate CAS Name: 6-methyl-2-[2-[2-(2-phenylphenoxy)ethoxy]ethylthio]-4-pyrimidinolate IUPAC Name: 6-methyl-2-[2-[2-(2-phenylphenoxy)ethoxy]ethylsulfanyl]pyrimidin-4-olate Traditional Name: 6-methyl-2-[2-[2-(2-phenylphenoxy)ethoxy]ethylthio]pyrimidin-4-olate Formula: C21H21N2O3S- MolecularWeight: 381.46804

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCCOCCOC2=CC=CC=C2C3=CC=CC=C3)[O-]

Isomeric SMILES

CC1=CC(=NC(=N1)SCCOCCOC2=CC=CC=C2C3=CC=CC=C3)[O-]

InChI

InChI=1S/C21H22N2O3S/c1-16-15-20(24)23-21(22-16)27-14-13-25-11-12-26-19-10-6-5-9-18(19)17-7-3-2-4-8-17/h2-10,15H,11-14H2,1H3,(H,22,23,24)/p-1