3-[(4-bromophenyl)carbamoyl]-1-butyl-1-methylsulfonyl-urea

Systemtic Name: 3-[(4-bromophenyl)carbamoyl]-1-butyl-1-methylsulfonyl-urea Openeye Name: 3-[(4-bromophenyl)carbamoyl]-1-butyl-1-methylsulfonyl-urea CAS Name: 3-[(4-bromoanilino)-oxomethyl]-1-butyl-1-methylsulfonylurea IUPAC Name: 3-[(4-bromophenyl)carbamoyl]-1-butyl-1-methylsulfonylurea Traditional Name: 3-[(4-bromophenyl)carbamoyl]-1-butyl-1-mesyl-urea Formula: C13H18BrN3O4S MolecularWeight: 392.26872

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C(=O)NC(=O)NC1=CC=C(C=C1)Br)S(=O)(=O)C

Isomeric SMILES

CCCCN(C(=O)NC(=O)NC1=CC=C(C=C1)Br)S(=O)(=O)C

InChI

InChI=1S/C13H18BrN3O4S/c1-3-4-9-17(22(2,20)21)13(19)16-12(18)15-11-7-5-10(14)6-8-11/h5-8H,3-4,9H2,1-2H3,(H2,15,16,18,19)