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

Systemtic Name: (2,5-ditert-butyl-1-ethanoyl-4-phenyl-6-sulfanyl-2,5-dihydropyridin-6-yl) ethanoate Openeye Name: (1-acetyl-2,5-ditert-butyl-4-phenyl-6-sulfanyl-2,5-dihydropyridin-6-yl) acetate CAS Name: acetic acid (1-acetyl-2,5-ditert-butyl-6-mercapto-4-phenyl-2,5-dihydropyridin-6-yl) ester IUPAC Name: (1-acetyl-2,5-ditert-butyl-4-phenyl-6-sulfanyl-2,5-dihydropyridin-6-yl) acetate Traditional Name: acetic acid (1-acetyl-2,5-ditert-butyl-6-mercapto-4-phenyl-2,5-dihydropyridin-6-yl) ester Formula: C23H33NO3S MolecularWeight: 403.57802

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C(C=C(C(C1(OC(=O)C)S)C(C)(C)C)C2=CC=CC=C2)C(C)(C)C

Isomeric SMILES

CC(=O)N1C(C=C(C(C1(OC(=O)C)S)C(C)(C)C)C2=CC=CC=C2)C(C)(C)C

InChI

InChI=1S/C23H33NO3S/c1-15(25)24-19(21(3,4)5)14-18(17-12-10-9-11-13-17)20(22(6,7)8)23(24,28)27-16(2)26/h9-14,19-20,28H,1-8H3