N-[2-chloranyl-5-(octadecylsulfamoyl)phenyl]-2-cyano-ethanamide

Systemtic Name: N-[2-chloranyl-5-(octadecylsulfamoyl)phenyl]-2-cyano-ethanamide Openeye Name: N-[2-chloro-5-(octadecylsulfamoyl)phenyl]-2-cyano-acetamide CAS Name: N-[2-chloro-5-(octadecylsulfamoyl)phenyl]-2-cyanoacetamide IUPAC Name: N-[2-chloro-5-(octadecylsulfamoyl)phenyl]-2-cyanoacetamide Traditional Name: N-[2-chloro-5-(stearylsulfamoyl)phenyl]-2-cyano-acetamide Formula: C27H44ClN3O3S MolecularWeight: 526.17456

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCNS(=O)(=O)C1=CC(=C(C=C1)Cl)NC(=O)CC#N

Isomeric SMILES

CCCCCCCCCCCCCCCCCCNS(=O)(=O)C1=CC(=C(C=C1)Cl)NC(=O)CC#N

InChI

InChI=1S/C27H44ClN3O3S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-22-30-35(33,34)24-18-19-25(28)26(23-24)31-27(32)20-21-29/h18-19,23,30H,2-17,20,22H2,1H3,(H,31,32)