4-[(5-morpholin-4-ylsulfonylpyridin-2-yl)sulfanylmethyl]benzenecarbonitrile

Systemtic Name: 4-[(5-morpholin-4-ylsulfonylpyridin-2-yl)sulfanylmethyl]benzenecarbonitrile Openeye Name: 4-[(5-morpholinosulfonyl-2-pyridyl)sulfanylmethyl]benzonitrile CAS Name: 4-[[[5-(4-morpholinylsulfonyl)-2-pyridinyl]thio]methyl]benzonitrile IUPAC Name: 4-[(5-morpholin-4-ylsulfonylpyridin-2-yl)sulfanylmethyl]benzonitrile Traditional Name: 4-[[(5-morpholinosulfonyl-2-pyridyl)thio]methyl]benzonitrile Formula: C17H17N3O3S2 MolecularWeight: 375.46518

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CN=C(C=C2)SCC3=CC=C(C=C3)C#N

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CN=C(C=C2)SCC3=CC=C(C=C3)C#N

InChI

InChI=1S/C17H17N3O3S2/c18-11-14-1-3-15(4-2-14)13-24-17-6-5-16(12-19-17)25(21,22)20-7-9-23-10-8-20/h1-6,12H,7-10,13H2