(4-bromophenyl)methyl 2-benzamido-4-methylsulfanyl-butanoate

Systemtic Name: (4-bromophenyl)methyl 2-benzamido-4-methylsulfanyl-butanoate Openeye Name: (4-bromophenyl)methyl 2-benzamido-4-methylsulfanyl-butanoate CAS Name: 2-benzamido-4-(methylthio)butanoic acid (4-bromophenyl)methyl ester IUPAC Name: (4-bromophenyl)methyl 2-benzamido-4-methylsulfanylbutanoate Traditional Name: 2-benzamido-4-(methylthio)butyric acid (4-bromobenzyl) ester Formula: C19H20BrNO3S MolecularWeight: 422.336

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)OCC1=CC=C(C=C1)Br)NC(=O)C2=CC=CC=C2

Isomeric SMILES

CSCCC(C(=O)OCC1=CC=C(C=C1)Br)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C19H20BrNO3S/c1-25-12-11-17(21-18(22)15-5-3-2-4-6-15)19(23)24-13-14-7-9-16(20)10-8-14/h2-10,17H,11-13H2,1H3,(H,21,22)