3-(3,5-ditert-butyl-4-oxidanyl-phenyl)sulfanyl-N-ethyl-N-(pyridin-4-ylmethyl)propanamide

Systemtic Name: 3-(3,5-ditert-butyl-4-oxidanyl-phenyl)sulfanyl-N-ethyl-N-(pyridin-4-ylmethyl)propanamide Openeye Name: 3-(3,5-ditert-butyl-4-hydroxy-phenyl)sulfanyl-N-ethyl-N-(4-pyridylmethyl)propanamide CAS Name: 3-[(3,5-ditert-butyl-4-hydroxyphenyl)thio]-N-ethyl-N-(pyridin-4-ylmethyl)propanamide IUPAC Name: 3-(3,5-ditert-butyl-4-hydroxyphenyl)sulfanyl-N-ethyl-N-(pyridin-4-ylmethyl)propanamide Traditional Name: 3-[(3,5-ditert-butyl-4-hydroxy-phenyl)thio]-N-ethyl-N-(4-pyridylmethyl)propionamide Formula: C25H36N2O2S MolecularWeight: 428.63054

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=NC=C1)C(=O)CCSC2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C

Isomeric SMILES

CCN(CC1=CC=NC=C1)C(=O)CCSC2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C

InChI

InChI=1S/C25H36N2O2S/c1-8-27(17-18-9-12-26-13-10-18)22(28)11-14-30-19-15-20(24(2,3)4)23(29)21(16-19)25(5,6)7/h9-10,12-13,15-16,29H,8,11,14,17H2,1-7H3