5-(1,3-benzothiazol-2-yl)-N-[[2-(dimethylaminomethyl)phenyl]methyl]pentanamide

Systemtic Name: 5-(1,3-benzothiazol-2-yl)-N-[[2-(dimethylaminomethyl)phenyl]methyl]pentanamide Openeye Name: 5-(1,3-benzothiazol-2-yl)-N-[[2-(dimethylaminomethyl)phenyl]methyl]pentanamide CAS Name: 5-(1,3-benzothiazol-2-yl)-N-[[2-(dimethylaminomethyl)phenyl]methyl]pentanamide IUPAC Name: 5-(1,3-benzothiazol-2-yl)-N-[[2-(dimethylaminomethyl)phenyl]methyl]pentanamide Traditional Name: 5-(1,3-benzothiazol-2-yl)-N-[2-(dimethylaminomethyl)benzyl]valeramide Formula: C22H27N3OS MolecularWeight: 381.53428

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1=CC=CC=C1CNC(=O)CCCCC2=NC3=CC=CC=C3S2

Isomeric SMILES

CN(C)CC1=CC=CC=C1CNC(=O)CCCCC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C22H27N3OS/c1-25(2)16-18-10-4-3-9-17(18)15-23-21(26)13-7-8-14-22-24-19-11-5-6-12-20(19)27-22/h3-6,9-12H,7-8,13-16H2,1-2H3,(H,23,26)