(Z)-3-[4-(4-tert-butyl-1,3-thiazol-2-yl)phenyl]-2-methylsulfonyl-prop-2-enenitrile

Systemtic Name: (Z)-3-[4-(4-tert-butyl-1,3-thiazol-2-yl)phenyl]-2-methylsulfonyl-prop-2-enenitrile Openeye Name: (Z)-3-[4-(4-tert-butylthiazol-2-yl)phenyl]-2-methylsulfonyl-prop-2-enenitrile CAS Name: (Z)-3-[4-(4-tert-butyl-2-thiazolyl)phenyl]-2-methylsulfonyl-2-propenenitrile IUPAC Name: (Z)-3-[4-(4-tert-butyl-1,3-thiazol-2-yl)phenyl]-2-methylsulfonylprop-2-enenitrile Traditional Name: (Z)-3-[4-(4-tert-butylthiazol-2-yl)phenyl]-2-mesyl-acrylonitrile Formula: C17H18N2O2S2 MolecularWeight: 346.46702

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CSC(=N1)C2=CC=C(C=C2)C=C(C#N)S(=O)(=O)C

Isomeric SMILES

CC(C)(C)C1=CSC(=N1)C2=CC=C(C=C2)/C=C(/C#N)\S(=O)(=O)C

InChI

InChI=1S/C17H18N2O2S2/c1-17(2,3)15-11-22-16(19-15)13-7-5-12(6-8-13)9-14(10-18)23(4,20)21/h5-9,11H,1-4H3/b14-9-