S-[(3,5-ditert-butyl-4-oxidanyl-phenyl)methyl] (E)-3-(4-methoxyphenyl)prop-2-enethioate

Systemtic Name: S-[(3,5-ditert-butyl-4-oxidanyl-phenyl)methyl] (E)-3-(4-methoxyphenyl)prop-2-enethioate Openeye Name: S-[(3,5-ditert-butyl-4-hydroxy-phenyl)methyl] (E)-3-(4-methoxyphenyl)prop-2-enethioate CAS Name: (E)-3-(4-methoxyphenyl)-2-propenethioic acid S-[(3,5-ditert-butyl-4-hydroxyphenyl)methyl] ester IUPAC Name: S-[(3,5-ditert-butyl-4-hydroxyphenyl)methyl] (E)-3-(4-methoxyphenyl)prop-2-enethioate Traditional Name: (E)-3-(4-methoxyphenyl)prop-2-enethioic acid S-(3,5-ditert-butyl-4-hydroxy-benzyl) ester Formula: C25H32O3S MolecularWeight: 412.58478

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CSC(=O)C=CC2=CC=C(C=C2)OC

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CSC(=O)/C=C/C2=CC=C(C=C2)OC

InChI

InChI=1S/C25H32O3S/c1-24(2,3)20-14-18(15-21(23(20)27)25(4,5)6)16-29-22(26)13-10-17-8-11-19(28-7)12-9-17/h8-15,27H,16H2,1-7H3/b13-10+