1-phenyl-3-(4-prop-2-enylsulfanylphenyl)pyrazole-4-carbaldehyde

Systemtic Name: 1-phenyl-3-(4-prop-2-enylsulfanylphenyl)pyrazole-4-carbaldehyde Openeye Name: 3-(4-allylsulfanylphenyl)-1-phenyl-pyrazole-4-carbaldehyde CAS Name: 1-phenyl-3-[4-(prop-2-enylthio)phenyl]-4-pyrazolecarboxaldehyde IUPAC Name: 1-phenyl-3-(4-prop-2-enylsulfanylphenyl)pyrazole-4-carbaldehyde Traditional Name: 3-[4-(allylthio)phenyl]-1-phenyl-pyrazole-4-carbaldehyde Formula: C19H16N2OS MolecularWeight: 320.40814

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Descriptors Computed from Structure

Canonical SMILES:

C=CCSC1=CC=C(C=C1)C2=NN(C=C2C=O)C3=CC=CC=C3

Isomeric SMILES

C=CCSC1=CC=C(C=C1)C2=NN(C=C2C=O)C3=CC=CC=C3

InChI

InChI=1S/C19H16N2OS/c1-2-12-23-18-10-8-15(9-11-18)19-16(14-22)13-21(20-19)17-6-4-3-5-7-17/h2-11,13-14H,1,12H2