pyridin-3-ylmethyl N-[4-(butylsulfamoyl)phenyl]sulfanylcarbamate

Systemtic Name: pyridin-3-ylmethyl N-[4-(butylsulfamoyl)phenyl]sulfanylcarbamate Openeye Name: 3-pyridylmethyl N-[4-(butylsulfamoyl)phenyl]sulfanylcarbamate CAS Name: N-[[4-(butylsulfamoyl)phenyl]thio]carbamic acid 3-pyridinylmethyl ester IUPAC Name: pyridin-3-ylmethyl N-[4-(butylsulfamoyl)phenyl]sulfanylcarbamate Traditional Name: N-[[4-(butylsulfamoyl)phenyl]thio]carbamic acid 3-pyridylmethyl ester Formula: C17H21N3O4S2 MolecularWeight: 395.49634

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNS(=O)(=O)C1=CC=C(C=C1)SNC(=O)OCC2=CN=CC=C2

Isomeric SMILES

CCCCNS(=O)(=O)C1=CC=C(C=C1)SNC(=O)OCC2=CN=CC=C2

InChI

InChI=1S/C17H21N3O4S2/c1-2-3-11-19-26(22,23)16-8-6-15(7-9-16)25-20-17(21)24-13-14-5-4-10-18-12-14/h4-10,12,19H,2-3,11,13H2,1H3,(H,20,21)