5-(3-methylbut-2-enylsulfanyl)-1,3-diphenyl-pyrazole-4-carbaldehyde

Systemtic Name: 5-(3-methylbut-2-enylsulfanyl)-1,3-diphenyl-pyrazole-4-carbaldehyde Openeye Name: 5-(3-methylbut-2-enylsulfanyl)-1,3-diphenyl-pyrazole-4-carbaldehyde CAS Name: 5-(3-methylbut-2-enylthio)-1,3-diphenyl-4-pyrazolecarboxaldehyde IUPAC Name: 5-(3-methylbut-2-enylsulfanyl)-1,3-diphenylpyrazole-4-carbaldehyde Traditional Name: 5-(3-methylbut-2-enylthio)-1,3-diphenyl-pyrazole-4-carbaldehyde Formula: C21H20N2OS MolecularWeight: 348.4613

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCSC1=C(C(=NN1C2=CC=CC=C2)C3=CC=CC=C3)C=O)C

Isomeric SMILES

CC(=CCSC1=C(C(=NN1C2=CC=CC=C2)C3=CC=CC=C3)C=O)C

InChI

InChI=1S/C21H20N2OS/c1-16(2)13-14-25-21-19(15-24)20(17-9-5-3-6-10-17)22-23(21)18-11-7-4-8-12-18/h3-13,15H,14H2,1-2H3