N-(6-bromanyl-1,3-benzothiazol-2-yl)-4-butoxy-N-(pyridin-2-ylmethyl)benzamide

Systemtic Name: N-(6-bromanyl-1,3-benzothiazol-2-yl)-4-butoxy-N-(pyridin-2-ylmethyl)benzamide Openeye Name: N-(6-bromo-1,3-benzothiazol-2-yl)-4-butoxy-N-(2-pyridylmethyl)benzamide CAS Name: N-(6-bromo-1,3-benzothiazol-2-yl)-4-butoxy-N-(2-pyridinylmethyl)benzamide IUPAC Name: N-(6-bromo-1,3-benzothiazol-2-yl)-4-butoxy-N-(pyridin-2-ylmethyl)benzamide Traditional Name: N-(6-bromo-1,3-benzothiazol-2-yl)-4-butoxy-N-(2-pyridylmethyl)benzamide Formula: C24H22BrN3O2S MolecularWeight: 496.41938

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)N(CC2=CC=CC=N2)C3=NC4=C(S3)C=C(C=C4)Br

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)N(CC2=CC=CC=N2)C3=NC4=C(S3)C=C(C=C4)Br

InChI

InChI=1S/C24H22BrN3O2S/c1-2-3-14-30-20-10-7-17(8-11-20)23(29)28(16-19-6-4-5-13-26-19)24-27-21-12-9-18(25)15-22(21)31-24/h4-13,15H,2-3,14,16H2,1H3