2-(4-methylphenyl)sulfonyl-4-phenylsulfanyl-pyrazole-3-carbaldehyde

Systemtic Name: 2-(4-methylphenyl)sulfonyl-4-phenylsulfanyl-pyrazole-3-carbaldehyde Openeye Name: 4-phenylsulfanyl-2-(p-tolylsulfonyl)pyrazole-3-carbaldehyde CAS Name: 2-(4-methylphenyl)sulfonyl-4-(phenylthio)-3-pyrazolecarboxaldehyde IUPAC Name: 2-(4-methylphenyl)sulfonyl-4-phenylsulfanylpyrazole-3-carbaldehyde Traditional Name: 4-(phenylthio)-2-tosyl-pyrazole-3-carbaldehyde Formula: C17H14N2O3S2 MolecularWeight: 358.43466

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C(=C(C=N2)SC3=CC=CC=C3)C=O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C(=C(C=N2)SC3=CC=CC=C3)C=O

InChI

InChI=1S/C17H14N2O3S2/c1-13-7-9-15(10-8-13)24(21,22)19-16(12-20)17(11-18-19)23-14-5-3-2-4-6-14/h2-12H,1H3