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

Systemtic Name: 3-methyl-6-[4-[4-(phenylmethyl)piperidin-1-yl]butyl]-1,3-benzothiazol-2-one Openeye Name: 6-[4-(4-benzyl-1-piperidyl)butyl]-3-methyl-1,3-benzothiazol-2-one CAS Name: 3-methyl-6-[4-[4-(phenylmethyl)-1-piperidinyl]butyl]-1,3-benzothiazol-2-one IUPAC Name: 6-[4-(4-benzylpiperidin-1-yl)butyl]-3-methyl-1,3-benzothiazol-2-one Traditional Name: 6-[4-(4-benzylpiperidino)butyl]-3-methyl-1,3-benzothiazol-2-one Formula: C24H30N2OS MolecularWeight: 394.5728

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)CCCCN3CCC(CC3)CC4=CC=CC=C4)SC1=O

Isomeric SMILES

CN1C2=C(C=C(C=C2)CCCCN3CCC(CC3)CC4=CC=CC=C4)SC1=O

InChI

InChI=1S/C24H30N2OS/c1-25-22-11-10-20(18-23(22)28-24(25)27)9-5-6-14-26-15-12-21(13-16-26)17-19-7-3-2-4-8-19/h2-4,7-8,10-11,18,21H,5-6,9,12-17H2,1H3