1-(2-chloranyl-5-methylsulfonyl-phenyl)-3-pentyl-urea

Systemtic Name: 1-(2-chloranyl-5-methylsulfonyl-phenyl)-3-pentyl-urea Openeye Name: 1-(2-chloro-5-methylsulfonyl-phenyl)-3-pentyl-urea CAS Name: 1-(2-chloro-5-methylsulfonylphenyl)-3-pentylurea IUPAC Name: 1-(2-chloro-5-methylsulfonylphenyl)-3-pentylurea Traditional Name: 1-amyl-3-(2-chloro-5-mesyl-phenyl)urea Formula: C13H19ClN2O3S MolecularWeight: 318.81956

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)NC1=C(C=CC(=C1)S(=O)(=O)C)Cl

Isomeric SMILES

CCCCCNC(=O)NC1=C(C=CC(=C1)S(=O)(=O)C)Cl

InChI

InChI=1S/C13H19ClN2O3S/c1-3-4-5-8-15-13(17)16-12-9-10(20(2,18)19)6-7-11(12)14/h6-7,9H,3-5,8H2,1-2H3,(H2,15,16,17)