6-methyl-2-[(E)-2-phenylethenyl]sulfanyl-pyrimidin-4-olate

Systemtic Name: 6-methyl-2-[(E)-2-phenylethenyl]sulfanyl-pyrimidin-4-olate Openeye Name: 6-methyl-2-[(E)-styryl]sulfanyl-pyrimidin-4-olate CAS Name: 6-methyl-2-[[(E)-2-phenylethenyl]thio]-4-pyrimidinolate IUPAC Name: 6-methyl-2-[(E)-2-phenylethenyl]sulfanylpyrimidin-4-olate Traditional Name: 6-methyl-2-[[(E)-styryl]thio]pyrimidin-4-olate Formula: C13H11N2OS- MolecularWeight: 243.30424

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SC=CC2=CC=CC=C2)[O-]

Isomeric SMILES

CC1=CC(=NC(=N1)S/C=C/C2=CC=CC=C2)[O-]

InChI

InChI=1S/C13H12N2OS/c1-10-9-12(16)15-13(14-10)17-8-7-11-5-3-2-4-6-11/h2-9H,1H3,(H,14,15,16)/p-1/b8-7+