N-[3-(1,3-benzothiazol-2-yl)phenyl]-3-bromanyl-4-ethoxy-benzamide

Systemtic Name: N-[3-(1,3-benzothiazol-2-yl)phenyl]-3-bromanyl-4-ethoxy-benzamide Openeye Name: N-[3-(1,3-benzothiazol-2-yl)phenyl]-3-bromo-4-ethoxy-benzamide CAS Name: N-[3-(1,3-benzothiazol-2-yl)phenyl]-3-bromo-4-ethoxybenzamide IUPAC Name: N-[3-(1,3-benzothiazol-2-yl)phenyl]-3-bromo-4-ethoxybenzamide Traditional Name: N-[3-(1,3-benzothiazol-2-yl)phenyl]-3-bromo-4-ethoxy-benzamide Formula: C22H17BrN2O2S MolecularWeight: 453.35158

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)NC2=CC=CC(=C2)C3=NC4=CC=CC=C4S3)Br

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)NC2=CC=CC(=C2)C3=NC4=CC=CC=C4S3)Br

InChI

InChI=1S/C22H17BrN2O2S/c1-2-27-19-11-10-14(13-17(19)23)21(26)24-16-7-5-6-15(12-16)22-25-18-8-3-4-9-20(18)28-22/h3-13H,2H2,1H3,(H,24,26)