1-(4-chloranyl-2-oxidanyl-3-piperazin-1-ylsulfonyl-phenyl)-3-cyclopentyl-urea

Systemtic Name: 1-(4-chloranyl-2-oxidanyl-3-piperazin-1-ylsulfonyl-phenyl)-3-cyclopentyl-urea Openeye Name: 1-(4-chloro-2-hydroxy-3-piperazin-1-ylsulfonyl-phenyl)-3-cyclopentyl-urea CAS Name: 1-[4-chloro-2-hydroxy-3-(1-piperazinylsulfonyl)phenyl]-3-cyclopentylurea IUPAC Name: 1-(4-chloro-2-hydroxy-3-piperazin-1-ylsulfonylphenyl)-3-cyclopentylurea Traditional Name: 1-(4-chloro-2-hydroxy-3-piperazinosulfonyl-phenyl)-3-cyclopentyl-urea Formula: C16H23ClN4O4S MolecularWeight: 402.89622

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC(=O)NC2=C(C(=C(C=C2)Cl)S(=O)(=O)N3CCNCC3)O

Isomeric SMILES

C1CCC(C1)NC(=O)NC2=C(C(=C(C=C2)Cl)S(=O)(=O)N3CCNCC3)O

InChI

InChI=1S/C16H23ClN4O4S/c17-12-5-6-13(20-16(23)19-11-3-1-2-4-11)14(22)15(12)26(24,25)21-9-7-18-8-10-21/h5-6,11,18,22H,1-4,7-10H2,(H2,19,20,23)