1-[4-chloranyl-2-oxidanyl-3-(piperazin-1-ylsulfamoyl)phenyl]-3-cyclopentyl-urea hydrochloride

Systemtic Name: 1-[4-chloranyl-2-oxidanyl-3-(piperazin-1-ylsulfamoyl)phenyl]-3-cyclopentyl-urea hydrochloride Openeye Name: 1-[4-chloro-2-hydroxy-3-(piperazin-1-ylsulfamoyl)phenyl]-3-cyclopentyl-urea hydrochloride CAS Name: 1-[4-chloro-2-hydroxy-3-(1-piperazinylsulfamoyl)phenyl]-3-cyclopentylurea hydrochloride IUPAC Name: 1-[4-chloro-2-hydroxy-3-(piperazin-1-ylsulfamoyl)phenyl]-3-cyclopentylurea hydrochloride Traditional Name: 1-[4-chloro-2-hydroxy-3-(piperazinosulfamoyl)phenyl]-3-cyclopentyl-urea hydrochloride Formula: C16H25Cl2N5O4S MolecularWeight: 454.3718

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC(=O)NC2=C(C(=C(C=C2)Cl)S(=O)(=O)NN3CCNCC3)O.Cl

Isomeric SMILES

C1CCC(C1)NC(=O)NC2=C(C(=C(C=C2)Cl)S(=O)(=O)NN3CCNCC3)O.Cl

InChI

InChI=1S/C16H24ClN5O4S.ClH/c17-12-5-6-13(20-16(24)19-11-3-1-2-4-11)14(23)15(12)27(25,26)21-22-9-7-18-8-10-22;/h5-6,11,18,21,23H,1-4,7-10H2,(H2,19,20,24);1H