(E)-3-[4-oxidanyl-3,5-di(propan-2-yl)phenyl]-2-thiophen-2-ylsulfonyl-prop-2-enenitrile

Systemtic Name: (E)-3-[4-oxidanyl-3,5-di(propan-2-yl)phenyl]-2-thiophen-2-ylsulfonyl-prop-2-enenitrile Openeye Name: (E)-3-(4-hydroxy-3,5-diisopropyl-phenyl)-2-(2-thienylsulfonyl)prop-2-enenitrile CAS Name: (E)-3-[4-hydroxy-3,5-di(propan-2-yl)phenyl]-2-thiophen-2-ylsulfonyl-2-propenenitrile IUPAC Name: (E)-3-[4-hydroxy-3,5-di(propan-2-yl)phenyl]-2-thiophen-2-ylsulfonylprop-2-enenitrile Traditional Name: (E)-3-(4-hydroxy-3,5-diisopropyl-phenyl)-2-(2-thienylsulfonyl)acrylonitrile Formula: C19H21NO3S2 MolecularWeight: 375.50494

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=CC(=C1O)C(C)C)C=C(C#N)S(=O)(=O)C2=CC=CS2

Isomeric SMILES

CC(C)C1=CC(=CC(=C1O)C(C)C)/C=C(\C#N)/S(=O)(=O)C2=CC=CS2

InChI

InChI=1S/C19H21NO3S2/c1-12(2)16-9-14(10-17(13(3)4)19(16)21)8-15(11-20)25(22,23)18-6-5-7-24-18/h5-10,12-13,21H,1-4H3/b15-8+