4-(3,5-ditert-butyl-4-oxidanyl-phenyl)-N,2,2-trimethyl-N-(2-pyridin-2-ylethyl)-3-sulfanylidene-butanamide

Systemtic Name: 4-(3,5-ditert-butyl-4-oxidanyl-phenyl)-N,2,2-trimethyl-N-(2-pyridin-2-ylethyl)-3-sulfanylidene-butanamide Openeye Name: 4-(3,5-ditert-butyl-4-hydroxy-phenyl)-N,2,2-trimethyl-N-[2-(2-pyridyl)ethyl]-3-thioxo-butanamide CAS Name: 4-(3,5-ditert-butyl-4-hydroxyphenyl)-N,2,2-trimethyl-N-[2-(2-pyridinyl)ethyl]-3-sulfanylidenebutanamide IUPAC Name: 4-(3,5-ditert-butyl-4-hydroxyphenyl)-N,2,2-trimethyl-N-(2-pyridin-2-ylethyl)-3-sulfanylidenebutanamide Traditional Name: 4-(3,5-ditert-butyl-4-hydroxy-phenyl)-N,2,2-trimethyl-N-[2-(2-pyridyl)ethyl]-3-thioxo-butyramide Formula: C28H40N2O2S MolecularWeight: 468.6944

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CC(=S)C(C)(C)C(=O)N(C)CCC2=CC=CC=N2

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CC(=S)C(C)(C)C(=O)N(C)CCC2=CC=CC=N2

InChI

InChI=1S/C28H40N2O2S/c1-26(2,3)21-16-19(17-22(24(21)31)27(4,5)6)18-23(33)28(7,8)25(32)30(9)15-13-20-12-10-11-14-29-20/h10-12,14,16-17,31H,13,15,18H2,1-9H3