3-methylsulfanyl-5-[(E)-2-(3,4,5-trimethoxyphenyl)ethenyl]-1H-pyrazole

Systemtic Name: 3-methylsulfanyl-5-[(E)-2-(3,4,5-trimethoxyphenyl)ethenyl]-1H-pyrazole Openeye Name: 3-methylsulfanyl-5-[(E)-2-(3,4,5-trimethoxyphenyl)vinyl]-1H-pyrazole CAS Name: 3-(methylthio)-5-[(E)-2-(3,4,5-trimethoxyphenyl)ethenyl]-1H-pyrazole IUPAC Name: 3-methylsulfanyl-5-[(E)-2-(3,4,5-trimethoxyphenyl)ethenyl]-1H-pyrazole Traditional Name: 3-(methylthio)-5-[(E)-2-(3,4,5-trimethoxyphenyl)vinyl]-1H-pyrazole Formula: C15H18N2O3S MolecularWeight: 306.38002

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C=CC2=CC(=NN2)SC

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)/C=C/C2=CC(=NN2)SC

InChI

InChI=1S/C15H18N2O3S/c1-18-12-7-10(8-13(19-2)15(12)20-3)5-6-11-9-14(21-4)17-16-11/h5-9H,1-4H3,(H,16,17)/b6-5+