1-(2-methyl-1,3-benzothiazol-6-yl)-3-oxidanyl-3-[1-(phenylmethyl)piperidin-4-yl]propan-1-one

Systemtic Name: 1-(2-methyl-1,3-benzothiazol-6-yl)-3-oxidanyl-3-[1-(phenylmethyl)piperidin-4-yl]propan-1-one Openeye Name: 3-(1-benzyl-4-piperidyl)-3-hydroxy-1-(2-methyl-1,3-benzothiazol-6-yl)propan-1-one CAS Name: 3-hydroxy-1-(2-methyl-1,3-benzothiazol-6-yl)-3-[1-(phenylmethyl)-4-piperidinyl]-1-propanone IUPAC Name: 3-(1-benzylpiperidin-4-yl)-3-hydroxy-1-(2-methyl-1,3-benzothiazol-6-yl)propan-1-one Traditional Name: 3-(1-benzyl-4-piperidyl)-3-hydroxy-1-(2-methyl-1,3-benzothiazol-6-yl)propan-1-one Formula: C23H26N2O2S MolecularWeight: 394.52974

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(S1)C=C(C=C2)C(=O)CC(C3CCN(CC3)CC4=CC=CC=C4)O

Isomeric SMILES

CC1=NC2=C(S1)C=C(C=C2)C(=O)CC(C3CCN(CC3)CC4=CC=CC=C4)O

InChI

InChI=1S/C23H26N2O2S/c1-16-24-20-8-7-19(13-23(20)28-16)22(27)14-21(26)18-9-11-25(12-10-18)15-17-5-3-2-4-6-17/h2-8,13,18,21,26H,9-12,14-15H2,1H3