(E)-3-(3,5-ditert-butyl-4-oxidanyl-phenyl)-N-[2-(1-methylimidazol-2-yl)sulfanylethyl]prop-2-enamide

Systemtic Name: (E)-3-(3,5-ditert-butyl-4-oxidanyl-phenyl)-N-[2-(1-methylimidazol-2-yl)sulfanylethyl]prop-2-enamide Openeye Name: (E)-3-(3,5-ditert-butyl-4-hydroxy-phenyl)-N-[2-(1-methylimidazol-2-yl)sulfanylethyl]prop-2-enamide CAS Name: (E)-3-(3,5-ditert-butyl-4-hydroxyphenyl)-N-[2-[(1-methyl-2-imidazolyl)thio]ethyl]-2-propenamide IUPAC Name: (E)-3-(3,5-ditert-butyl-4-hydroxyphenyl)-N-[2-(1-methylimidazol-2-yl)sulfanylethyl]prop-2-enamide Traditional Name: (E)-3-(3,5-ditert-butyl-4-hydroxy-phenyl)-N-[2-[(1-methylimidazol-2-yl)thio]ethyl]acrylamide Formula: C23H33N3O2S MolecularWeight: 415.59202

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C=CC(=O)NCCSC2=NC=CN2C

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)/C=C/C(=O)NCCSC2=NC=CN2C

InChI

InChI=1S/C23H33N3O2S/c1-22(2,3)17-14-16(15-18(20(17)28)23(4,5)6)8-9-19(27)24-11-13-29-21-25-10-12-26(21)7/h8-10,12,14-15,28H,11,13H2,1-7H3,(H,24,27)/b9-8+