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

Systemtic Name: 2-[[4-[(4,5-dimethoxy-2-methyl-phenyl)methyl]piperazin-1-yl]methyl]-1,3-benzothiazole Openeye Name: 2-[[4-[(4,5-dimethoxy-2-methyl-phenyl)methyl]piperazin-1-yl]methyl]-1,3-benzothiazole CAS Name: 2-[[4-[(4,5-dimethoxy-2-methylphenyl)methyl]-1-piperazinyl]methyl]-1,3-benzothiazole IUPAC Name: 2-[[4-[(4,5-dimethoxy-2-methylphenyl)methyl]piperazin-1-yl]methyl]-1,3-benzothiazole Traditional Name: 2-[[4-(4,5-dimethoxy-2-methyl-benzyl)piperazino]methyl]-1,3-benzothiazole Formula: C22H27N3O2S MolecularWeight: 397.53368

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1CN2CCN(CC2)CC3=NC4=CC=CC=C4S3)OC)OC

Isomeric SMILES

CC1=CC(=C(C=C1CN2CCN(CC2)CC3=NC4=CC=CC=C4S3)OC)OC

InChI

InChI=1S/C22H27N3O2S/c1-16-12-19(26-2)20(27-3)13-17(16)14-24-8-10-25(11-9-24)15-22-23-18-6-4-5-7-21(18)28-22/h4-7,12-13H,8-11,14-15H2,1-3H3