N-[4-[3-(dimethylamino)pyrrolidin-1-yl]carbonyl-1,3-thiazol-2-yl]-3-fluoranyl-benzamide

Systemtic Name: N-[4-[3-(dimethylamino)pyrrolidin-1-yl]carbonyl-1,3-thiazol-2-yl]-3-fluoranyl-benzamide Openeye Name: N-[4-[3-(dimethylamino)pyrrolidine-1-carbonyl]thiazol-2-yl]-3-fluoro-benzamide CAS Name: N-[4-[[3-(dimethylamino)-1-pyrrolidinyl]-oxomethyl]-2-thiazolyl]-3-fluorobenzamide IUPAC Name: N-[4-[3-(dimethylamino)pyrrolidine-1-carbonyl]-1,3-thiazol-2-yl]-3-fluorobenzamide Traditional Name: N-[4-[3-(dimethylamino)pyrrolidine-1-carbonyl]thiazol-2-yl]-3-fluoro-benzamide Formula: C17H19FN4O2S MolecularWeight: 362.421763

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1CCN(C1)C(=O)C2=CSC(=N2)NC(=O)C3=CC(=CC=C3)F

Isomeric SMILES

CN(C)C1CCN(C1)C(=O)C2=CSC(=N2)NC(=O)C3=CC(=CC=C3)F

InChI

InChI=1S/C17H19FN4O2S/c1-21(2)13-6-7-22(9-13)16(24)14-10-25-17(19-14)20-15(23)11-4-3-5-12(18)8-11/h3-5,8,10,13H,6-7,9H2,1-2H3,(H,19,20,23)