(E)-3-(3,5-dimethyl-4-oxidanyl-phenyl)-2-thiophen-2-ylsulfonyl-prop-2-enenitrile

Systemtic Name: (E)-3-(3,5-dimethyl-4-oxidanyl-phenyl)-2-thiophen-2-ylsulfonyl-prop-2-enenitrile Openeye Name: (E)-3-(4-hydroxy-3,5-dimethyl-phenyl)-2-(2-thienylsulfonyl)prop-2-enenitrile CAS Name: (E)-3-(4-hydroxy-3,5-dimethylphenyl)-2-thiophen-2-ylsulfonyl-2-propenenitrile IUPAC Name: (E)-3-(4-hydroxy-3,5-dimethylphenyl)-2-thiophen-2-ylsulfonylprop-2-enenitrile Traditional Name: (E)-3-(4-hydroxy-3,5-dimethyl-phenyl)-2-(2-thienylsulfonyl)acrylonitrile Formula: C15H13NO3S2 MolecularWeight: 319.39862

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1O)C)C=C(C#N)S(=O)(=O)C2=CC=CS2

Isomeric SMILES

CC1=CC(=CC(=C1O)C)/C=C(\C#N)/S(=O)(=O)C2=CC=CS2

InChI

InChI=1S/C15H13NO3S2/c1-10-6-12(7-11(2)15(10)17)8-13(9-16)21(18,19)14-4-3-5-20-14/h3-8,17H,1-2H3/b13-8+