1-butyl-3-[4-(phenylsulfonylamino)phenyl]sulfonyl-urea

Systemtic Name: 1-butyl-3-[4-(phenylsulfonylamino)phenyl]sulfonyl-urea Openeye Name: 1-[4-(benzenesulfonamido)phenyl]sulfonyl-3-butyl-urea CAS Name: 1-[4-(benzenesulfonamido)phenyl]sulfonyl-3-butylurea IUPAC Name: 1-[4-(benzenesulfonamido)phenyl]sulfonyl-3-butylurea Traditional Name: 1-[4-(benzenesulfonamido)phenyl]sulfonyl-3-butyl-urea Formula: C17H21N3O5S2 MolecularWeight: 411.49574

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)NS(=O)(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CCCCNC(=O)NS(=O)(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C17H21N3O5S2/c1-2-3-13-18-17(21)20-27(24,25)16-11-9-14(10-12-16)19-26(22,23)15-7-5-4-6-8-15/h4-12,19H,2-3,13H2,1H3,(H2,18,20,21)