N-(4-tert-butylphenyl)-2-[[(3S)-3,5-dicyano-4,4-dimethyl-2-oxidanylidene-1,3-dihydropyridin-6-yl]sulfanyl]ethanamide

Systemtic Name: N-(4-tert-butylphenyl)-2-[[(3S)-3,5-dicyano-4,4-dimethyl-2-oxidanylidene-1,3-dihydropyridin-6-yl]sulfanyl]ethanamide Openeye Name: N-(4-tert-butylphenyl)-2-[[(3S)-3,5-dicyano-4,4-dimethyl-2-oxo-1,3-dihydropyridin-6-yl]sulfanyl]acetamide CAS Name: N-(4-tert-butylphenyl)-2-[[(3S)-3,5-dicyano-4,4-dimethyl-2-oxo-1,3-dihydropyridin-6-yl]thio]acetamide IUPAC Name: N-(4-tert-butylphenyl)-2-[[(3S)-3,5-dicyano-4,4-dimethyl-2-oxo-1,3-dihydropyridin-6-yl]sulfanyl]acetamide Traditional Name: N-(4-tert-butylphenyl)-2-[[(3S)-3,5-dicyano-2-keto-4,4-dimethyl-1,3-dihydropyridin-6-yl]thio]acetamide Formula: C21H24N4O2S MolecularWeight: 396.50586

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(=O)NC(=C1C#N)SCC(=O)NC2=CC=C(C=C2)C(C)(C)C)C#N)C

Isomeric SMILES

CC1([C@H](C(=O)NC(=C1C#N)SCC(=O)NC2=CC=C(C=C2)C(C)(C)C)C#N)C

InChI

InChI=1S/C21H24N4O2S/c1-20(2,3)13-6-8-14(9-7-13)24-17(26)12-28-19-16(11-23)21(4,5)15(10-22)18(27)25-19/h6-9,15H,12H2,1-5H3,(H,24,26)(H,25,27)/t15-/m0/s1