4-[5-(3-morpholin-4-ylpyrrolidin-1-yl)sulfonylpyridin-2-yl]benzenecarbonitrile

Systemtic Name: 4-[5-(3-morpholin-4-ylpyrrolidin-1-yl)sulfonylpyridin-2-yl]benzenecarbonitrile Openeye Name: 4-[5-(3-morpholinopyrrolidin-1-yl)sulfonyl-2-pyridyl]benzonitrile CAS Name: 4-[5-[[3-(4-morpholinyl)-1-pyrrolidinyl]sulfonyl]-2-pyridinyl]benzonitrile IUPAC Name: 4-[5-(3-morpholin-4-ylpyrrolidin-1-yl)sulfonylpyridin-2-yl]benzonitrile Traditional Name: 4-[5-(3-morpholinopyrrolidino)sulfonyl-2-pyridyl]benzonitrile Formula: C20H22N4O3S MolecularWeight: 398.47868

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC1N2CCOCC2)S(=O)(=O)C3=CN=C(C=C3)C4=CC=C(C=C4)C#N

Isomeric SMILES

C1CN(CC1N2CCOCC2)S(=O)(=O)C3=CN=C(C=C3)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C20H22N4O3S/c21-13-16-1-3-17(4-2-16)20-6-5-19(14-22-20)28(25,26)24-8-7-18(15-24)23-9-11-27-12-10-23/h1-6,14,18H,7-12,15H2