N-(6-bromanyl-1,3-benzothiazol-2-yl)-4-cyano-N-(2-morpholin-4-ylethyl)benzamide

Systemtic Name: N-(6-bromanyl-1,3-benzothiazol-2-yl)-4-cyano-N-(2-morpholin-4-ylethyl)benzamide Openeye Name: N-(6-bromo-1,3-benzothiazol-2-yl)-4-cyano-N-(2-morpholinoethyl)benzamide CAS Name: N-(6-bromo-1,3-benzothiazol-2-yl)-4-cyano-N-[2-(4-morpholinyl)ethyl]benzamide IUPAC Name: N-(6-bromo-1,3-benzothiazol-2-yl)-4-cyano-N-(2-morpholin-4-ylethyl)benzamide Traditional Name: N-(6-bromo-1,3-benzothiazol-2-yl)-4-cyano-N-(2-morpholinoethyl)benzamide Formula: C21H19BrN4O2S MolecularWeight: 471.37016

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCN(C2=NC3=C(S2)C=C(C=C3)Br)C(=O)C4=CC=C(C=C4)C#N

Isomeric SMILES

C1COCCN1CCN(C2=NC3=C(S2)C=C(C=C3)Br)C(=O)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C21H19BrN4O2S/c22-17-5-6-18-19(13-17)29-21(24-18)26(8-7-25-9-11-28-12-10-25)20(27)16-3-1-15(14-23)2-4-16/h1-6,13H,7-12H2