butyl 4-[2-[2,6-bis(chloranyl)phenyl]sulfanylethanoylamino]benzoate

Systemtic Name: butyl 4-[2-[2,6-bis(chloranyl)phenyl]sulfanylethanoylamino]benzoate Openeye Name: butyl 4-[[2-(2,6-dichlorophenyl)sulfanylacetyl]amino]benzoate CAS Name: 4-[[2-[(2,6-dichlorophenyl)thio]-1-oxoethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[[2-(2,6-dichlorophenyl)sulfanylacetyl]amino]benzoate Traditional Name: 4-[[2-[(2,6-dichlorophenyl)thio]acetyl]amino]benzoic acid butyl ester Formula: C19H19Cl2NO3S MolecularWeight: 412.33006

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)CSC2=C(C=CC=C2Cl)Cl

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)CSC2=C(C=CC=C2Cl)Cl

InChI

InChI=1S/C19H19Cl2NO3S/c1-2-3-11-25-19(24)13-7-9-14(10-8-13)22-17(23)12-26-18-15(20)5-4-6-16(18)21/h4-10H,2-3,11-12H2,1H3,(H,22,23)