2-bromanyl-N-(5,7-dimethyl-1,3-benzothiazol-2-yl)-N-(pyridin-2-ylmethyl)benzamide

Systemtic Name: 2-bromanyl-N-(5,7-dimethyl-1,3-benzothiazol-2-yl)-N-(pyridin-2-ylmethyl)benzamide Openeye Name: 2-bromo-N-(5,7-dimethyl-1,3-benzothiazol-2-yl)-N-(2-pyridylmethyl)benzamide CAS Name: 2-bromo-N-(5,7-dimethyl-1,3-benzothiazol-2-yl)-N-(2-pyridinylmethyl)benzamide IUPAC Name: 2-bromo-N-(5,7-dimethyl-1,3-benzothiazol-2-yl)-N-(pyridin-2-ylmethyl)benzamide Traditional Name: 2-bromo-N-(5,7-dimethyl-1,3-benzothiazol-2-yl)-N-(2-pyridylmethyl)benzamide Formula: C22H18BrN3OS MolecularWeight: 452.36682

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)N=C(S2)N(CC3=CC=CC=N3)C(=O)C4=CC=CC=C4Br)C

Isomeric SMILES

CC1=CC(=C2C(=C1)N=C(S2)N(CC3=CC=CC=N3)C(=O)C4=CC=CC=C4Br)C

InChI

InChI=1S/C22H18BrN3OS/c1-14-11-15(2)20-19(12-14)25-22(28-20)26(13-16-7-5-6-10-24-16)21(27)17-8-3-4-9-18(17)23/h3-12H,13H2,1-2H3