1-butan-2-yl-3-(2-methyl-5-methylsulfonyl-phenyl)urea

Systemtic Name: 1-butan-2-yl-3-(2-methyl-5-methylsulfonyl-phenyl)urea Openeye Name: 1-(2-methyl-5-methylsulfonyl-phenyl)-3-sec-butyl-urea CAS Name: 1-butan-2-yl-3-(2-methyl-5-methylsulfonylphenyl)urea IUPAC Name: 1-butan-2-yl-3-(2-methyl-5-methylsulfonylphenyl)urea Traditional Name: 1-(5-mesyl-2-methyl-phenyl)-3-sec-butyl-urea Formula: C13H20N2O3S MolecularWeight: 284.3745

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)NC1=C(C=CC(=C1)S(=O)(=O)C)C

Isomeric SMILES

CCC(C)NC(=O)NC1=C(C=CC(=C1)S(=O)(=O)C)C

InChI

InChI=1S/C13H20N2O3S/c1-5-10(3)14-13(16)15-12-8-11(19(4,17)18)7-6-9(12)2/h6-8,10H,5H2,1-4H3,(H2,14,15,16)