1-(1,3-benzothiazol-2-ylmethyl)-N-[[2-(dimethylaminomethyl)phenyl]methyl]cyclohexane-1-carboxamide

Systemtic Name: 1-(1,3-benzothiazol-2-ylmethyl)-N-[[2-(dimethylaminomethyl)phenyl]methyl]cyclohexane-1-carboxamide Openeye Name: 1-(1,3-benzothiazol-2-ylmethyl)-N-[[2-(dimethylaminomethyl)phenyl]methyl]cyclohexanecarboxamide CAS Name: 1-(1,3-benzothiazol-2-ylmethyl)-N-[[2-(dimethylaminomethyl)phenyl]methyl]-1-cyclohexanecarboxamide IUPAC Name: 1-(1,3-benzothiazol-2-ylmethyl)-N-[[2-(dimethylaminomethyl)phenyl]methyl]cyclohexane-1-carboxamide Traditional Name: 1-(1,3-benzothiazol-2-ylmethyl)-N-[2-(dimethylaminomethyl)benzyl]cyclohexanecarboxamide Formula: C25H31N3OS MolecularWeight: 421.59814

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1=CC=CC=C1CNC(=O)C2(CCCCC2)CC3=NC4=CC=CC=C4S3

Isomeric SMILES

CN(C)CC1=CC=CC=C1CNC(=O)C2(CCCCC2)CC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C25H31N3OS/c1-28(2)18-20-11-5-4-10-19(20)17-26-24(29)25(14-8-3-9-15-25)16-23-27-21-12-6-7-13-22(21)30-23/h4-7,10-13H,3,8-9,14-18H2,1-2H3,(H,26,29)