N-(6-bromanyl-1,3-benzothiazol-2-yl)-3-methyl-N-(3-morpholin-4-ylpropyl)benzamide

Systemtic Name: N-(6-bromanyl-1,3-benzothiazol-2-yl)-3-methyl-N-(3-morpholin-4-ylpropyl)benzamide Openeye Name: N-(6-bromo-1,3-benzothiazol-2-yl)-3-methyl-N-(3-morpholinopropyl)benzamide CAS Name: N-(6-bromo-1,3-benzothiazol-2-yl)-3-methyl-N-[3-(4-morpholinyl)propyl]benzamide IUPAC Name: N-(6-bromo-1,3-benzothiazol-2-yl)-3-methyl-N-(3-morpholin-4-ylpropyl)benzamide Traditional Name: N-(6-bromo-1,3-benzothiazol-2-yl)-3-methyl-N-(3-morpholinopropyl)benzamide Formula: C22H24BrN3O2S MolecularWeight: 474.41386

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)N(CCCN2CCOCC2)C3=NC4=C(S3)C=C(C=C4)Br

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)N(CCCN2CCOCC2)C3=NC4=C(S3)C=C(C=C4)Br

InChI

InChI=1S/C22H24BrN3O2S/c1-16-4-2-5-17(14-16)21(27)26(9-3-8-25-10-12-28-13-11-25)22-24-19-7-6-18(23)15-20(19)29-22/h2,4-7,14-15H,3,8-13H2,1H3