2-[2-(4-bromanyl-2-methyl-phenyl)sulfanylethanoyl-propyl-amino]-N-(2-methoxyphenyl)ethanamide

Systemtic Name: 2-[2-(4-bromanyl-2-methyl-phenyl)sulfanylethanoyl-propyl-amino]-N-(2-methoxyphenyl)ethanamide Openeye Name: 2-[[2-(4-bromo-2-methyl-phenyl)sulfanylacetyl]-propyl-amino]-N-(2-methoxyphenyl)acetamide CAS Name: 2-[[2-[(4-bromo-2-methylphenyl)thio]-1-oxoethyl]-propylamino]-N-(2-methoxyphenyl)acetamide IUPAC Name: 2-[[2-(4-bromo-2-methylphenyl)sulfanylacetyl]-propylamino]-N-(2-methoxyphenyl)acetamide Traditional Name: 2-[[2-[(4-bromo-2-methyl-phenyl)thio]acetyl]-propyl-amino]-N-(2-methoxyphenyl)acetamide Formula: C21H25BrN2O3S MolecularWeight: 465.4038

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC(=O)NC1=CC=CC=C1OC)C(=O)CSC2=C(C=C(C=C2)Br)C

Isomeric SMILES

CCCN(CC(=O)NC1=CC=CC=C1OC)C(=O)CSC2=C(C=C(C=C2)Br)C

InChI

InChI=1S/C21H25BrN2O3S/c1-4-11-24(13-20(25)23-17-7-5-6-8-18(17)27-3)21(26)14-28-19-10-9-16(22)12-15(19)2/h5-10,12H,4,11,13-14H2,1-3H3,(H,23,25)