1-methyl-3-phenyl-5-phenylsulfanyl-pyrazole-4-carbaldehyde

Systemtic Name: 1-methyl-3-phenyl-5-phenylsulfanyl-pyrazole-4-carbaldehyde Openeye Name: 1-methyl-3-phenyl-5-phenylsulfanyl-pyrazole-4-carbaldehyde CAS Name: 1-methyl-3-phenyl-5-(phenylthio)-4-pyrazolecarboxaldehyde IUPAC Name: 1-methyl-3-phenyl-5-phenylsulfanylpyrazole-4-carbaldehyde Traditional Name: 1-methyl-3-phenyl-5-(phenylthio)pyrazole-4-carbaldehyde Formula: C17H14N2OS MolecularWeight: 294.37086

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=N1)C2=CC=CC=C2)C=O)SC3=CC=CC=C3

Isomeric SMILES

CN1C(=C(C(=N1)C2=CC=CC=C2)C=O)SC3=CC=CC=C3

InChI

InChI=1S/C17H14N2OS/c1-19-17(21-14-10-6-3-7-11-14)15(12-20)16(18-19)13-8-4-2-5-9-13/h2-12H,1H3