3-[(Z)-2-tert-butylsulfonyl-2-cyano-ethenyl]-6-(dimethylamino)-2-fluoranyl-benzenecarbonitrile

Systemtic Name: 3-[(Z)-2-tert-butylsulfonyl-2-cyano-ethenyl]-6-(dimethylamino)-2-fluoranyl-benzenecarbonitrile Openeye Name: 3-[(Z)-2-tert-butylsulfonyl-2-cyano-vinyl]-6-(dimethylamino)-2-fluoro-benzonitrile CAS Name: 3-[(Z)-2-tert-butylsulfonyl-2-cyanoethenyl]-6-(dimethylamino)-2-fluorobenzonitrile IUPAC Name: 3-[(Z)-2-tert-butylsulfonyl-2-cyanoethenyl]-6-(dimethylamino)-2-fluorobenzonitrile Traditional Name: 3-[(Z)-2-tert-butylsulfonyl-2-cyano-vinyl]-6-(dimethylamino)-2-fluoro-benzonitrile Formula: C16H18FN3O2S MolecularWeight: 335.396423

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)S(=O)(=O)C(=CC1=C(C(=C(C=C1)N(C)C)C#N)F)C#N

Isomeric SMILES

CC(C)(C)S(=O)(=O)/C(=C\C1=C(C(=C(C=C1)N(C)C)C#N)F)/C#N

InChI

InChI=1S/C16H18FN3O2S/c1-16(2,3)23(21,22)12(9-18)8-11-6-7-14(20(4)5)13(10-19)15(11)17/h6-8H,1-5H3/b12-8-