N-[2-(4-dimethylaminophenyl)-2-pyrrolidin-1-yl-ethyl]-1,3-benzothiazole-2-carboxamide

Systemtic Name: N-[2-(4-dimethylaminophenyl)-2-pyrrolidin-1-yl-ethyl]-1,3-benzothiazole-2-carboxamide Openeye Name: N-[2-(4-dimethylaminophenyl)-2-pyrrolidin-1-yl-ethyl]-1,3-benzothiazole-2-carboxamide CAS Name: N-[2-(4-dimethylaminophenyl)-2-(1-pyrrolidinyl)ethyl]-1,3-benzothiazole-2-carboxamide IUPAC Name: N-[2-(4-dimethylaminophenyl)-2-pyrrolidin-1-ylethyl]-1,3-benzothiazole-2-carboxamide Traditional Name: N-[2-(4-dimethylaminophenyl)-2-pyrrolidino-ethyl]-1,3-benzothiazole-2-carboxamide Formula: C22H26N4OS MolecularWeight: 394.53304

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C(CNC(=O)C2=NC3=CC=CC=C3S2)N4CCCC4

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C(CNC(=O)C2=NC3=CC=CC=C3S2)N4CCCC4

InChI

InChI=1S/C22H26N4OS/c1-25(2)17-11-9-16(10-12-17)19(26-13-5-6-14-26)15-23-21(27)22-24-18-7-3-4-8-20(18)28-22/h3-4,7-12,19H,5-6,13-15H2,1-2H3,(H,23,27)