4-[2-(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)sulfanylethoxy]benzenecarbonitrile

Systemtic Name: 4-[2-(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)sulfanylethoxy]benzenecarbonitrile Openeye Name: 4-[2-[(5-pyrrolidin-1-ylsulfonyl-2-pyridyl)sulfanyl]ethoxy]benzonitrile CAS Name: 4-[2-[[5-(1-pyrrolidinylsulfonyl)-2-pyridinyl]thio]ethoxy]benzonitrile IUPAC Name: 4-[2-(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)sulfanylethoxy]benzonitrile Traditional Name: 4-[2-[(5-pyrrolidinosulfonyl-2-pyridyl)thio]ethoxy]benzonitrile Formula: C18H19N3O3S2 MolecularWeight: 389.49176

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CN=C(C=C2)SCCOC3=CC=C(C=C3)C#N

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CN=C(C=C2)SCCOC3=CC=C(C=C3)C#N

InChI

InChI=1S/C18H19N3O3S2/c19-13-15-3-5-16(6-4-15)24-11-12-25-18-8-7-17(14-20-18)26(22,23)21-9-1-2-10-21/h3-8,14H,1-2,9-12H2