2-(4-fluoranylphenoxy)-N-[2-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)sulfanyl-1,3-benzothiazol-6-yl]ethanamide

Systemtic Name: 2-(4-fluoranylphenoxy)-N-[2-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)sulfanyl-1,3-benzothiazol-6-yl]ethanamide Openeye Name: 2-(4-fluorophenoxy)-N-[2-(2-oxo-2-pyrrolidin-1-yl-ethyl)sulfanyl-1,3-benzothiazol-6-yl]acetamide CAS Name: 2-(4-fluorophenoxy)-N-[2-[[2-oxo-2-(1-pyrrolidinyl)ethyl]thio]-1,3-benzothiazol-6-yl]acetamide IUPAC Name: 2-(4-fluorophenoxy)-N-[2-(2-oxo-2-pyrrolidin-1-ylethyl)sulfanyl-1,3-benzothiazol-6-yl]acetamide Traditional Name: 2-(4-fluorophenoxy)-N-[2-[(2-keto-2-pyrrolidino-ethyl)thio]-1,3-benzothiazol-6-yl]acetamide Formula: C21H20FN3O3S2 MolecularWeight: 445.530203

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)CSC2=NC3=C(S2)C=C(C=C3)NC(=O)COC4=CC=C(C=C4)F

Isomeric SMILES

C1CCN(C1)C(=O)CSC2=NC3=C(S2)C=C(C=C3)NC(=O)COC4=CC=C(C=C4)F

InChI

InChI=1S/C21H20FN3O3S2/c22-14-3-6-16(7-4-14)28-12-19(26)23-15-5-8-17-18(11-15)30-21(24-17)29-13-20(27)25-9-1-2-10-25/h3-8,11H,1-2,9-10,12-13H2,(H,23,26)