N-(6-ethyl-1,3-benzothiazol-2-yl)-4-[(2-oxidanylidenepyrrolidin-1-yl)methyl]benzamide

Systemtic Name: N-(6-ethyl-1,3-benzothiazol-2-yl)-4-[(2-oxidanylidenepyrrolidin-1-yl)methyl]benzamide Openeye Name: N-(6-ethyl-1,3-benzothiazol-2-yl)-4-[(2-oxopyrrolidin-1-yl)methyl]benzamide CAS Name: N-(6-ethyl-1,3-benzothiazol-2-yl)-4-[(2-oxo-1-pyrrolidinyl)methyl]benzamide IUPAC Name: N-(6-ethyl-1,3-benzothiazol-2-yl)-4-[(2-oxopyrrolidin-1-yl)methyl]benzamide Traditional Name: N-(6-ethyl-1,3-benzothiazol-2-yl)-4-[(2-ketopyrrolidino)methyl]benzamide Formula: C21H21N3O2S MolecularWeight: 379.47534

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC=C(C=C3)CN4CCCC4=O

Isomeric SMILES

CCC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC=C(C=C3)CN4CCCC4=O

InChI

InChI=1S/C21H21N3O2S/c1-2-14-7-10-17-18(12-14)27-21(22-17)23-20(26)16-8-5-15(6-9-16)13-24-11-3-4-19(24)25/h5-10,12H,2-4,11,13H2,1H3,(H,22,23,26)