propan-2-yl 4-[2-(4-bromophenyl)sulfanylethanoylamino]benzoate

Systemtic Name: propan-2-yl 4-[2-(4-bromophenyl)sulfanylethanoylamino]benzoate Openeye Name: isopropyl 4-[[2-(4-bromophenyl)sulfanylacetyl]amino]benzoate CAS Name: 4-[[2-[(4-bromophenyl)thio]-1-oxoethyl]amino]benzoic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-[[2-(4-bromophenyl)sulfanylacetyl]amino]benzoate Traditional Name: 4-[[2-[(4-bromophenyl)thio]acetyl]amino]benzoic acid isopropyl ester Formula: C18H18BrNO3S MolecularWeight: 408.30942

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=CC=C(C=C1)NC(=O)CSC2=CC=C(C=C2)Br

Isomeric SMILES

CC(C)OC(=O)C1=CC=C(C=C1)NC(=O)CSC2=CC=C(C=C2)Br

InChI

InChI=1S/C18H18BrNO3S/c1-12(2)23-18(22)13-3-7-15(8-4-13)20-17(21)11-24-16-9-5-14(19)6-10-16/h3-10,12H,11H2,1-2H3,(H,20,21)