1-butyl-3-(2-methylsulfinylphenyl)sulfonyl-urea

Systemtic Name: 1-butyl-3-(2-methylsulfinylphenyl)sulfonyl-urea Openeye Name: 1-butyl-3-(2-methylsulfinylphenyl)sulfonyl-urea CAS Name: 1-butyl-3-(2-methylsulfinylphenyl)sulfonylurea IUPAC Name: 1-butyl-3-(2-methylsulfinylphenyl)sulfonylurea Traditional Name: 1-butyl-3-(2-methylsulfinylphenyl)sulfonyl-urea Formula: C12H18N2O4S2 MolecularWeight: 318.41232

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)NS(=O)(=O)C1=CC=CC=C1S(=O)C

Isomeric SMILES

CCCCNC(=O)NS(=O)(=O)C1=CC=CC=C1S(=O)C

InChI

InChI=1S/C12H18N2O4S2/c1-3-4-9-13-12(15)14-20(17,18)11-8-6-5-7-10(11)19(2)16/h5-8H,3-4,9H2,1-2H3,(H2,13,14,15)