4-[1-[2,4-bis(fluoranyl)phenyl]sulfonylpyrazol-3-yl]-3-methyl-5-methylsulfanyl-thiophene-2-carbonitrile

Systemtic Name: 4-[1-[2,4-bis(fluoranyl)phenyl]sulfonylpyrazol-3-yl]-3-methyl-5-methylsulfanyl-thiophene-2-carbonitrile Openeye Name: 4-[1-(2,4-difluorophenyl)sulfonylpyrazol-3-yl]-3-methyl-5-methylsulfanyl-thiophene-2-carbonitrile CAS Name: 4-[1-(2,4-difluorophenyl)sulfonyl-3-pyrazolyl]-3-methyl-5-(methylthio)-2-thiophenecarbonitrile IUPAC Name: 4-[1-(2,4-difluorophenyl)sulfonylpyrazol-3-yl]-3-methyl-5-methylsulfanylthiophene-2-carbonitrile Traditional Name: 4-[1-(2,4-difluorophenyl)sulfonylpyrazol-3-yl]-3-methyl-5-(methylthio)thiophene-2-carbonitrile Formula: C16H11F2N3O2S3 MolecularWeight: 411.469246

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C2=NN(C=C2)S(=O)(=O)C3=C(C=C(C=C3)F)F)SC)C#N

Isomeric SMILES

CC1=C(SC(=C1C2=NN(C=C2)S(=O)(=O)C3=C(C=C(C=C3)F)F)SC)C#N

InChI

InChI=1S/C16H11F2N3O2S3/c1-9-13(8-19)25-16(24-2)15(9)12-5-6-21(20-12)26(22,23)14-4-3-10(17)7-11(14)18/h3-7H,1-2H3