1-(1,3-benzodioxol-5-ylmethyl)-4-[1-(thian-4-yl)piperidin-3-yl]piperazine

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-[1-(thian-4-yl)piperidin-3-yl]piperazine Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-(1-tetrahydrothiopyran-4-yl-3-piperidyl)piperazine CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-[1-(4-thianyl)-3-piperidinyl]piperazine IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-[1-(thian-4-yl)piperidin-3-yl]piperazine Traditional Name: 1-piperonyl-4-(1-tetrahydrothiopyran-4-yl-3-piperidyl)piperazine Formula: C22H33N3O2S MolecularWeight: 403.58132

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2CCSCC2)N3CCN(CC3)CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1CC(CN(C1)C2CCSCC2)N3CCN(CC3)CC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C22H33N3O2S/c1-2-20(16-25(7-1)19-5-12-28-13-6-19)24-10-8-23(9-11-24)15-18-3-4-21-22(14-18)27-17-26-21/h3-4,14,19-20H,1-2,5-13,15-17H2