(Z)-3-[5-(4-fluorophenyl)-4-(4-methylsulfonylphenyl)thiophen-2-yl]but-2-enenitrile

Systemtic Name: (Z)-3-[5-(4-fluorophenyl)-4-(4-methylsulfonylphenyl)thiophen-2-yl]but-2-enenitrile Openeye Name: (Z)-3-[5-(4-fluorophenyl)-4-(4-methylsulfonylphenyl)-2-thienyl]but-2-enenitrile CAS Name: (Z)-3-[5-(4-fluorophenyl)-4-(4-methylsulfonylphenyl)-2-thiophenyl]-2-butenenitrile IUPAC Name: (Z)-3-[5-(4-fluorophenyl)-4-(4-methylsulfonylphenyl)thiophen-2-yl]but-2-enenitrile Traditional Name: (Z)-3-[5-(4-fluorophenyl)-4-(4-mesylphenyl)-2-thienyl]but-2-enenitrile Formula: C21H16FNO2S2 MolecularWeight: 397.485643

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC#N)C1=CC(=C(S1)C2=CC=C(C=C2)F)C3=CC=C(C=C3)S(=O)(=O)C

Isomeric SMILES

C/C(=C/C#N)/C1=CC(=C(S1)C2=CC=C(C=C2)F)C3=CC=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C21H16FNO2S2/c1-14(11-12-23)20-13-19(15-5-9-18(10-6-15)27(2,24)25)21(26-20)16-3-7-17(22)8-4-16/h3-11,13H,1-2H3/b14-11-