2-(3-butylsulfanyl-2-oxidanyl-propyl)sulfanyl-4,6-diphenyl-pyridine-3-carbonitrile

Systemtic Name: 2-(3-butylsulfanyl-2-oxidanyl-propyl)sulfanyl-4,6-diphenyl-pyridine-3-carbonitrile Openeye Name: 2-(3-butylsulfanyl-2-hydroxy-propyl)sulfanyl-4,6-diphenyl-pyridine-3-carbonitrile CAS Name: 2-[[3-(butylthio)-2-hydroxypropyl]thio]-4,6-diphenyl-3-pyridinecarbonitrile IUPAC Name: 2-(3-butylsulfanyl-2-hydroxypropyl)sulfanyl-4,6-diphenylpyridine-3-carbonitrile Traditional Name: 2-[[3-(butylthio)-2-hydroxy-propyl]thio]-4,6-diphenyl-nicotinonitrile Formula: C25H26N2OS2 MolecularWeight: 434.61674

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSCC(CSC1=C(C(=CC(=N1)C2=CC=CC=C2)C3=CC=CC=C3)C#N)O

Isomeric SMILES

CCCCSCC(CSC1=C(C(=CC(=N1)C2=CC=CC=C2)C3=CC=CC=C3)C#N)O

InChI

InChI=1S/C25H26N2OS2/c1-2-3-14-29-17-21(28)18-30-25-23(16-26)22(19-10-6-4-7-11-19)15-24(27-25)20-12-8-5-9-13-20/h4-13,15,21,28H,2-3,14,17-18H2,1H3