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

Systemtic Name: N-(6-bromanyl-1,3-benzothiazol-2-yl)-4-butoxy-benzamide Openeye Name: N-(6-bromo-1,3-benzothiazol-2-yl)-4-butoxy-benzamide CAS Name: N-(6-bromo-1,3-benzothiazol-2-yl)-4-butoxybenzamide IUPAC Name: N-(6-bromo-1,3-benzothiazol-2-yl)-4-butoxybenzamide Traditional Name: N-(6-bromo-1,3-benzothiazol-2-yl)-4-butoxy-benzamide Formula: C18H17BrN2O2S MolecularWeight: 405.30878

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)NC2=NC3=C(S2)C=C(C=C3)Br

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)NC2=NC3=C(S2)C=C(C=C3)Br

InChI

InChI=1S/C18H17BrN2O2S/c1-2-3-10-23-14-7-4-12(5-8-14)17(22)21-18-20-15-9-6-13(19)11-16(15)24-18/h4-9,11H,2-3,10H2,1H3,(H,20,21,22)