(4R)-2-butylsulfanyl-5-ethanoyl-6-methyl-4-phenyl-1,4-dihydropyridine-3-carbonitrile

Systemtic Name: (4R)-2-butylsulfanyl-5-ethanoyl-6-methyl-4-phenyl-1,4-dihydropyridine-3-carbonitrile Openeye Name: (4R)-5-acetyl-2-butylsulfanyl-6-methyl-4-phenyl-1,4-dihydropyridine-3-carbonitrile CAS Name: (4R)-5-acetyl-2-(butylthio)-6-methyl-4-phenyl-1,4-dihydropyridine-3-carbonitrile IUPAC Name: (4R)-5-acetyl-2-butylsulfanyl-6-methyl-4-phenyl-1,4-dihydropyridine-3-carbonitrile Traditional Name: (4R)-5-acetyl-2-(butylthio)-6-methyl-4-phenyl-1,4-dihydropyridine-3-carbonitrile Formula: C19H22N2OS MolecularWeight: 326.45578

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=C(C(C(=C(N1)C)C(=O)C)C2=CC=CC=C2)C#N

Isomeric SMILES

CCCCSC1=C([C@@H](C(=C(N1)C)C(=O)C)C2=CC=CC=C2)C#N

InChI

InChI=1S/C19H22N2OS/c1-4-5-11-23-19-16(12-20)18(15-9-7-6-8-10-15)17(14(3)22)13(2)21-19/h6-10,18,21H,4-5,11H2,1-3H3/t18-/m0/s1