3-fluoranyl-4-[(5-piperidin-1-ylsulfonyl-2,3-dihydroindol-1-yl)methyl]benzenecarbonitrile

Systemtic Name: 3-fluoranyl-4-[(5-piperidin-1-ylsulfonyl-2,3-dihydroindol-1-yl)methyl]benzenecarbonitrile Openeye Name: 3-fluoro-4-[[5-(1-piperidylsulfonyl)indolin-1-yl]methyl]benzonitrile CAS Name: 3-fluoro-4-[[5-(1-piperidinylsulfonyl)-2,3-dihydroindol-1-yl]methyl]benzonitrile IUPAC Name: 3-fluoro-4-[(5-piperidin-1-ylsulfonyl-2,3-dihydroindol-1-yl)methyl]benzonitrile Traditional Name: 3-fluoro-4-[(5-piperidinosulfonylindolin-1-yl)methyl]benzonitrile Formula: C21H22FN3O2S MolecularWeight: 399.481683

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)N(CC3)CC4=C(C=C(C=C4)C#N)F

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)N(CC3)CC4=C(C=C(C=C4)C#N)F

InChI

InChI=1S/C21H22FN3O2S/c22-20-12-16(14-23)4-5-18(20)15-24-11-8-17-13-19(6-7-21(17)24)28(26,27)25-9-2-1-3-10-25/h4-7,12-13H,1-3,8-11,15H2