1-(1,3-benzothiazol-2-yl)-N-(4,5-dimethoxy-2-methyl-phenyl)piperidine-3-carboxamide

Systemtic Name: 1-(1,3-benzothiazol-2-yl)-N-(4,5-dimethoxy-2-methyl-phenyl)piperidine-3-carboxamide Openeye Name: 1-(1,3-benzothiazol-2-yl)-N-(4,5-dimethoxy-2-methyl-phenyl)piperidine-3-carboxamide CAS Name: 1-(1,3-benzothiazol-2-yl)-N-(4,5-dimethoxy-2-methylphenyl)-3-piperidinecarboxamide IUPAC Name: 1-(1,3-benzothiazol-2-yl)-N-(4,5-dimethoxy-2-methylphenyl)piperidine-3-carboxamide Traditional Name: 1-(1,3-benzothiazol-2-yl)-N-(4,5-dimethoxy-2-methyl-phenyl)nipecotamide Formula: C22H25N3O3S MolecularWeight: 411.5172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1NC(=O)C2CCCN(C2)C3=NC4=CC=CC=C4S3)OC)OC

Isomeric SMILES

CC1=CC(=C(C=C1NC(=O)C2CCCN(C2)C3=NC4=CC=CC=C4S3)OC)OC

InChI

InChI=1S/C22H25N3O3S/c1-14-11-18(27-2)19(28-3)12-17(14)23-21(26)15-7-6-10-25(13-15)22-24-16-8-4-5-9-20(16)29-22/h4-5,8-9,11-12,15H,6-7,10,13H2,1-3H3,(H,23,26)