(1-naphthalen-2-ylsulfonylpiperidin-3-yl)-(1-pyridin-4-ylpiperidin-4-yl)methanone

Systemtic Name: (1-naphthalen-2-ylsulfonylpiperidin-3-yl)-(1-pyridin-4-ylpiperidin-4-yl)methanone Openeye Name: [1-(2-naphthylsulfonyl)-3-piperidyl]-[1-(4-pyridyl)-4-piperidyl]methanone CAS Name: [1-(2-naphthalenylsulfonyl)-3-piperidinyl]-(1-pyridin-4-yl-4-piperidinyl)methanone IUPAC Name: (1-naphthalen-2-ylsulfonylpiperidin-3-yl)-(1-pyridin-4-ylpiperidin-4-yl)methanone Traditional Name: [1-(2-naphthylsulfonyl)-3-piperidyl]-[1-(4-pyridyl)-4-piperidyl]methanone Formula: C26H29N3O3S MolecularWeight: 463.59176

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=CC3=CC=CC=C3C=C2)C(=O)C4CCN(CC4)C5=CC=NC=C5

Isomeric SMILES

C1CC(CN(C1)S(=O)(=O)C2=CC3=CC=CC=C3C=C2)C(=O)C4CCN(CC4)C5=CC=NC=C5

InChI

InChI=1S/C26H29N3O3S/c30-26(21-11-16-28(17-12-21)24-9-13-27-14-10-24)23-6-3-15-29(19-23)33(31,32)25-8-7-20-4-1-2-5-22(20)18-25/h1-2,4-5,7-10,13-14,18,21,23H,3,6,11-12,15-17,19H2