[3-[1-(pyridin-4-ylmethyl)piperidin-4-yl]oxyphenyl]-thiomorpholin-4-yl-methanone

Systemtic Name: [3-[1-(pyridin-4-ylmethyl)piperidin-4-yl]oxyphenyl]-thiomorpholin-4-yl-methanone Openeye Name: [3-[[1-(4-pyridylmethyl)-4-piperidyl]oxy]phenyl]-thiomorpholino-methanone CAS Name: [3-[[1-(pyridin-4-ylmethyl)-4-piperidinyl]oxy]phenyl]-thiomorpholin-4-ylmethanone IUPAC Name: [3-[1-(pyridin-4-ylmethyl)piperidin-4-yl]oxyphenyl]-thiomorpholin-4-ylmethanone Traditional Name: [3-[[1-(4-pyridylmethyl)-4-piperidyl]oxy]phenyl]-thiomorpholino-methanone Formula: C22H27N3O2S MolecularWeight: 397.53368

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1OC2=CC=CC(=C2)C(=O)N3CCSCC3)CC4=CC=NC=C4

Isomeric SMILES

C1CN(CCC1OC2=CC=CC(=C2)C(=O)N3CCSCC3)CC4=CC=NC=C4

InChI

InChI=1S/C22H27N3O2S/c26-22(25-12-14-28-15-13-25)19-2-1-3-21(16-19)27-20-6-10-24(11-7-20)17-18-4-8-23-9-5-18/h1-5,8-9,16,20H,6-7,10-15,17H2