(2,5-ditert-butyl-1-ethanoyl-6-sulfanyl-2,5-dihydropyridin-6-yl) ethanoate

Systemtic Name: (2,5-ditert-butyl-1-ethanoyl-6-sulfanyl-2,5-dihydropyridin-6-yl) ethanoate Openeye Name: (1-acetyl-2,5-ditert-butyl-6-sulfanyl-2,5-dihydropyridin-6-yl) acetate CAS Name: acetic acid (1-acetyl-2,5-ditert-butyl-6-mercapto-2,5-dihydropyridin-6-yl) ester IUPAC Name: (1-acetyl-2,5-ditert-butyl-6-sulfanyl-2,5-dihydropyridin-6-yl) acetate Traditional Name: acetic acid (1-acetyl-2,5-ditert-butyl-6-mercapto-2,5-dihydropyridin-6-yl) ester Formula: C17H29NO3S MolecularWeight: 327.48206

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C(C=CC(C1(OC(=O)C)S)C(C)(C)C)C(C)(C)C

Isomeric SMILES

CC(=O)N1C(C=CC(C1(OC(=O)C)S)C(C)(C)C)C(C)(C)C

InChI

InChI=1S/C17H29NO3S/c1-11(19)18-14(16(6,7)8)10-9-13(15(3,4)5)17(18,22)21-12(2)20/h9-10,13-14,22H,1-8H3