1-(4-methylphenyl)sulfonyl-3-(octanoylamino)urea

Systemtic Name: 1-(4-methylphenyl)sulfonyl-3-(octanoylamino)urea Openeye Name: 1-(octanoylamino)-3-(p-tolylsulfonyl)urea CAS Name: 1-(4-methylphenyl)sulfonyl-3-(1-oxooctylamino)urea IUPAC Name: 1-(4-methylphenyl)sulfonyl-3-(octanoylamino)urea Traditional Name: 1-(caprylylamino)-3-tosyl-urea Formula: C16H25N3O4S MolecularWeight: 355.4524

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)NNC(=O)NS(=O)(=O)C1=CC=C(C=C1)C

Isomeric SMILES

CCCCCCCC(=O)NNC(=O)NS(=O)(=O)C1=CC=C(C=C1)C

InChI

InChI=1S/C16H25N3O4S/c1-3-4-5-6-7-8-15(20)17-18-16(21)19-24(22,23)14-11-9-13(2)10-12-14/h9-12H,3-8H2,1-2H3,(H,17,20)(H2,18,19,21)