N-[2-chloranyl-5-(phenylsulfamoyl)phenyl]-3-(2-octadecoxyphenyl)-3-oxidanylidene-propanamide

Systemtic Name: N-[2-chloranyl-5-(phenylsulfamoyl)phenyl]-3-(2-octadecoxyphenyl)-3-oxidanylidene-propanamide Openeye Name: N-[2-chloro-5-(phenylsulfamoyl)phenyl]-3-(2-octadecoxyphenyl)-3-oxo-propanamide CAS Name: N-[2-chloro-5-(phenylsulfamoyl)phenyl]-3-(2-octadecoxyphenyl)-3-oxopropanamide IUPAC Name: N-[2-chloro-5-(phenylsulfamoyl)phenyl]-3-(2-octadecoxyphenyl)-3-oxopropanamide Traditional Name: N-[2-chloro-5-(phenylsulfamoyl)phenyl]-3-keto-3-(2-stearyloxyphenyl)propionamide Formula: C39H53ClN2O5S MolecularWeight: 697.36652

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC1=CC=CC=C1C(=O)CC(=O)NC2=C(C=CC(=C2)S(=O)(=O)NC3=CC=CC=C3)Cl

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC1=CC=CC=C1C(=O)CC(=O)NC2=C(C=CC(=C2)S(=O)(=O)NC3=CC=CC=C3)Cl

InChI

InChI=1S/C39H53ClN2O5S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-22-29-47-38-26-21-20-25-34(38)37(43)31-39(44)41-36-30-33(27-28-35(36)40)48(45,46)42-32-23-18-17-19-24-32/h17-21,23-28,30,42H,2-16,22,29,31H2,1H3,(H,41,44)