(4S)-3-ethanoyl-2-methyl-4-phenyl-6-(phenylsulfanylmethylsulfanyl)-3,4-dihydropyridine-5-carbonitrile

Systemtic Name: (4S)-3-ethanoyl-2-methyl-4-phenyl-6-(phenylsulfanylmethylsulfanyl)-3,4-dihydropyridine-5-carbonitrile Openeye Name: (4S)-3-acetyl-2-methyl-4-phenyl-6-(phenylsulfanylmethylsulfanyl)-3,4-dihydropyridine-5-carbonitrile CAS Name: (4S)-3-acetyl-2-methyl-4-phenyl-6-[(phenylthio)methylthio]-3,4-dihydropyridine-5-carbonitrile IUPAC Name: (4S)-3-acetyl-2-methyl-4-phenyl-6-(phenylsulfanylmethylsulfanyl)-3,4-dihydropyridine-5-carbonitrile Traditional Name: (4S)-3-acetyl-2-methyl-4-phenyl-6-[(phenylthio)methylthio]-3,4-dihydropyridine-5-carbonitrile Formula: C22H20N2OS2 MolecularWeight: 392.537

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(C1C(=O)C)C2=CC=CC=C2)C#N)SCSC3=CC=CC=C3

Isomeric SMILES

CC1=NC(=C([C@@H](C1C(=O)C)C2=CC=CC=C2)C#N)SCSC3=CC=CC=C3

InChI

InChI=1S/C22H20N2OS2/c1-15-20(16(2)25)21(17-9-5-3-6-10-17)19(13-23)22(24-15)27-14-26-18-11-7-4-8-12-18/h3-12,20-21H,14H2,1-2H3/t20?,21-/m0/s1