3-[8-(1-propan-2-ylsulfonylpiperidin-4-yl)oxyisoquinolin-6-yl]benzenecarbonitrile

Systemtic Name: 3-[8-(1-propan-2-ylsulfonylpiperidin-4-yl)oxyisoquinolin-6-yl]benzenecarbonitrile Openeye Name: 3-[8-[(1-isopropylsulfonyl-4-piperidyl)oxy]-6-isoquinolyl]benzonitrile CAS Name: 3-[8-[(1-propan-2-ylsulfonyl-4-piperidinyl)oxy]-6-isoquinolinyl]benzonitrile IUPAC Name: 3-[8-(1-propan-2-ylsulfonylpiperidin-4-yl)oxyisoquinolin-6-yl]benzonitrile Traditional Name: 3-[8-[(1-isopropylsulfonyl-4-piperidyl)oxy]-6-isoquinolyl]benzonitrile Formula: C24H25N3O3S MolecularWeight: 435.5386

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)N1CCC(CC1)OC2=C3C=NC=CC3=CC(=C2)C4=CC=CC(=C4)C#N

Isomeric SMILES

CC(C)S(=O)(=O)N1CCC(CC1)OC2=C3C=NC=CC3=CC(=C2)C4=CC=CC(=C4)C#N

InChI

InChI=1S/C24H25N3O3S/c1-17(2)31(28,29)27-10-7-22(8-11-27)30-24-14-21(13-20-6-9-26-16-23(20)24)19-5-3-4-18(12-19)15-25/h3-6,9,12-14,16-17,22H,7-8,10-11H2,1-2H3