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5-ethanoyl-4-(4-ethylphenyl)-6-methyl-2-(3-methylbut-2-enylsulfanyl)-1,4-dihydropyridine-3-carbonitrile
5-ethanoyl-4-(4-ethylphenyl)-6-methyl-2-(3-methylbut-2-enylsulfanyl)-1,4-dihydropyridine-3-carbonitrile
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Descriptors Computed from Structure
Canonical SMILES:
CCC1=CC=C(C=C1)C2C(=C(NC(=C2C(=O)C)C)SCC=C(C)C)C#N
Isomeric SMILES
CCC1=CC=C(C=C1)C2C(=C(NC(=C2C(=O)C)C)SCC=C(C)C)C#N
InChI
InChI=1S/C22H26N2OS/c1-6-17-7-9-18(10-8-17)21-19(13-23)22(26-12-11-14(2)3)24-15(4)20(21)16(5)25/h7-11,21,24H,6,12H2,1-5H3
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- 5-ethanoyl-6-methyl-2-(3-methylbut-2-enylsulfanyl)-4-(3-methylthiophen-2-yl)-1,4-dihydropyridine-3-carbonitrile
