N-(2,3-dimethylcyclohexyl)-1-(6-methoxy-1,3-benzothiazol-2-yl)piperidine-3-carboxamide

Systemtic Name: N-(2,3-dimethylcyclohexyl)-1-(6-methoxy-1,3-benzothiazol-2-yl)piperidine-3-carboxamide Openeye Name: N-(2,3-dimethylcyclohexyl)-1-(6-methoxy-1,3-benzothiazol-2-yl)piperidine-3-carboxamide CAS Name: N-(2,3-dimethylcyclohexyl)-1-(6-methoxy-1,3-benzothiazol-2-yl)-3-piperidinecarboxamide IUPAC Name: N-(2,3-dimethylcyclohexyl)-1-(6-methoxy-1,3-benzothiazol-2-yl)piperidine-3-carboxamide Traditional Name: N-(2,3-dimethylcyclohexyl)-1-(6-methoxy-1,3-benzothiazol-2-yl)nipecotamide Formula: C22H31N3O2S MolecularWeight: 401.56544

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1C)NC(=O)C2CCCN(C2)C3=NC4=C(S3)C=C(C=C4)OC

Isomeric SMILES

CC1CCCC(C1C)NC(=O)C2CCCN(C2)C3=NC4=C(S3)C=C(C=C4)OC

InChI

InChI=1S/C22H31N3O2S/c1-14-6-4-8-18(15(14)2)23-21(26)16-7-5-11-25(13-16)22-24-19-10-9-17(27-3)12-20(19)28-22/h9-10,12,14-16,18H,4-8,11,13H2,1-3H3,(H,23,26)