3-(1,3-benzothiazol-2-yl)-N-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]propanamide

Systemtic Name: 3-(1,3-benzothiazol-2-yl)-N-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]propanamide Openeye Name: 3-(1,3-benzothiazol-2-yl)-N-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]propanamide CAS Name: 3-(1,3-benzothiazol-2-yl)-N-[[4-(1-pyrrolidinylmethyl)phenyl]methyl]propanamide IUPAC Name: 3-(1,3-benzothiazol-2-yl)-N-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]propanamide Traditional Name: 3-(1,3-benzothiazol-2-yl)-N-[4-(pyrrolidinomethyl)benzyl]propionamide Formula: C22H25N3OS MolecularWeight: 379.5184

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC2=CC=C(C=C2)CNC(=O)CCC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1CCN(C1)CC2=CC=C(C=C2)CNC(=O)CCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C22H25N3OS/c26-21(11-12-22-24-19-5-1-2-6-20(19)27-22)23-15-17-7-9-18(10-8-17)16-25-13-3-4-14-25/h1-2,5-10H,3-4,11-16H2,(H,23,26)