N-(2-azanyl-5-propylsulfanyl-phenyl)propane-1-sulfonamide

Systemtic Name: N-(2-azanyl-5-propylsulfanyl-phenyl)propane-1-sulfonamide Openeye Name: N-(2-amino-5-propylsulfanyl-phenyl)propane-1-sulfonamide CAS Name: N-[2-amino-5-(propylthio)phenyl]-1-propanesulfonamide IUPAC Name: N-(2-amino-5-propylsulfanylphenyl)propane-1-sulfonamide Traditional Name: N-[2-amino-5-(propylthio)phenyl]propane-1-sulfonamide Formula: C12H20N2O2S2 MolecularWeight: 288.4294

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=CC(=C(C=C1)N)NS(=O)(=O)CCC

Isomeric SMILES

CCCSC1=CC(=C(C=C1)N)NS(=O)(=O)CCC

InChI

InChI=1S/C12H20N2O2S2/c1-3-7-17-10-5-6-11(13)12(9-10)14-18(15,16)8-4-2/h5-6,9,14H,3-4,7-8,13H2,1-2H3