5-(furan-2-ylmethylsulfanyl)-3-methyl-1-phenyl-pyrazole-4-carbaldehyde

Systemtic Name: 5-(furan-2-ylmethylsulfanyl)-3-methyl-1-phenyl-pyrazole-4-carbaldehyde Openeye Name: 5-(2-furylmethylsulfanyl)-3-methyl-1-phenyl-pyrazole-4-carbaldehyde CAS Name: 5-(2-furanylmethylthio)-3-methyl-1-phenyl-4-pyrazolecarboxaldehyde IUPAC Name: 5-(furan-2-ylmethylsulfanyl)-3-methyl-1-phenylpyrazole-4-carbaldehyde Traditional Name: 5-(2-furfurylthio)-3-methyl-1-phenyl-pyrazole-4-carbaldehyde Formula: C16H14N2O2S MolecularWeight: 298.35956

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=O)SCC2=CC=CO2)C3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(=C1C=O)SCC2=CC=CO2)C3=CC=CC=C3

InChI

InChI=1S/C16H14N2O2S/c1-12-15(10-19)16(21-11-14-8-5-9-20-14)18(17-12)13-6-3-2-4-7-13/h2-10H,11H2,1H3