(2,5-ditert-butyl-1-ethanoyl-4-methyl-6-sulfanyl-2,5-dihydropyridin-6-yl) ethanoate

Systemtic Name: (2,5-ditert-butyl-1-ethanoyl-4-methyl-6-sulfanyl-2,5-dihydropyridin-6-yl) ethanoate Openeye Name: (1-acetyl-2,5-ditert-butyl-4-methyl-6-sulfanyl-2,5-dihydropyridin-6-yl) acetate CAS Name: acetic acid (1-acetyl-2,5-ditert-butyl-6-mercapto-4-methyl-2,5-dihydropyridin-6-yl) ester IUPAC Name: (1-acetyl-2,5-ditert-butyl-4-methyl-6-sulfanyl-2,5-dihydropyridin-6-yl) acetate Traditional Name: acetic acid (1-acetyl-2,5-ditert-butyl-6-mercapto-4-methyl-2,5-dihydropyridin-6-yl) ester Formula: C18H31NO3S MolecularWeight: 341.50864

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(N(C(C1C(C)(C)C)(OC(=O)C)S)C(=O)C)C(C)(C)C

Isomeric SMILES

CC1=CC(N(C(C1C(C)(C)C)(OC(=O)C)S)C(=O)C)C(C)(C)C

InChI

InChI=1S/C18H31NO3S/c1-11-10-14(16(4,5)6)19(12(2)20)18(23,22-13(3)21)15(11)17(7,8)9/h10,14-15,23H,1-9H3