2-[(2R)-1-[(4,5-dimethoxy-2-methyl-phenyl)methyl]piperidin-2-yl]-1,3-benzothiazole

Systemtic Name: 2-[(2R)-1-[(4,5-dimethoxy-2-methyl-phenyl)methyl]piperidin-2-yl]-1,3-benzothiazole Openeye Name: 2-[(2R)-1-[(4,5-dimethoxy-2-methyl-phenyl)methyl]-2-piperidyl]-1,3-benzothiazole CAS Name: 2-[(2R)-1-[(4,5-dimethoxy-2-methylphenyl)methyl]-2-piperidinyl]-1,3-benzothiazole IUPAC Name: 2-[(2R)-1-[(4,5-dimethoxy-2-methylphenyl)methyl]piperidin-2-yl]-1,3-benzothiazole Traditional Name: 2-[(2R)-1-(4,5-dimethoxy-2-methyl-benzyl)-2-piperidyl]-1,3-benzothiazole Formula: C22H26N2O2S MolecularWeight: 382.51904

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1CN2CCCCC2C3=NC4=CC=CC=C4S3)OC)OC

Isomeric SMILES

CC1=CC(=C(C=C1CN2CCCC[C@@H]2C3=NC4=CC=CC=C4S3)OC)OC

InChI

InChI=1S/C22H26N2O2S/c1-15-12-19(25-2)20(26-3)13-16(15)14-24-11-7-6-9-18(24)22-23-17-8-4-5-10-21(17)27-22/h4-5,8,10,12-13,18H,6-7,9,11,14H2,1-3H3/t18-/m1/s1