5-bromanyl-3-methoxy-2-[2-(2-methylphenoxy)ethoxy]benzenecarbothioamide

Systemtic Name: 5-bromanyl-3-methoxy-2-[2-(2-methylphenoxy)ethoxy]benzenecarbothioamide Openeye Name: 5-bromo-3-methoxy-2-[2-(2-methylphenoxy)ethoxy]benzenecarbothioamide CAS Name: 5-bromo-3-methoxy-2-[2-(2-methylphenoxy)ethoxy]benzenecarbothioamide IUPAC Name: 5-bromo-3-methoxy-2-[2-(2-methylphenoxy)ethoxy]benzenecarbothioamide Traditional Name: 5-bromo-3-methoxy-2-[2-(2-methylphenoxy)ethoxy]thiobenzamide Formula: C17H18BrNO3S MolecularWeight: 396.29872

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OCCOC2=C(C=C(C=C2C(=S)N)Br)OC

Isomeric SMILES

CC1=CC=CC=C1OCCOC2=C(C=C(C=C2C(=S)N)Br)OC

InChI

InChI=1S/C17H18BrNO3S/c1-11-5-3-4-6-14(11)21-7-8-22-16-13(17(19)23)9-12(18)10-15(16)20-2/h3-6,9-10H,7-8H2,1-2H3,(H2,19,23)