2-(1,2-benzoxazol-3-yl)-1-[4-(3-chloranyl-4-fluoranyl-phenyl)sulfonylpiperazin-1-yl]ethanone

Systemtic Name: 2-(1,2-benzoxazol-3-yl)-1-[4-(3-chloranyl-4-fluoranyl-phenyl)sulfonylpiperazin-1-yl]ethanone Openeye Name: 2-(1,2-benzoxazol-3-yl)-1-[4-(3-chloro-4-fluoro-phenyl)sulfonylpiperazin-1-yl]ethanone CAS Name: 2-(1,2-benzoxazol-3-yl)-1-[4-(3-chloro-4-fluorophenyl)sulfonyl-1-piperazinyl]ethanone IUPAC Name: 2-(1,2-benzoxazol-3-yl)-1-[4-(3-chloro-4-fluorophenyl)sulfonylpiperazin-1-yl]ethanone Traditional Name: 1-[4-(3-chloro-4-fluoro-phenyl)sulfonylpiperazino]-2-indoxazen-3-yl-ethanone Formula: C19H17ClFN3O4S MolecularWeight: 437.872383

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CC2=NOC3=CC=CC=C32)S(=O)(=O)C4=CC(=C(C=C4)F)Cl

Isomeric SMILES

C1CN(CCN1C(=O)CC2=NOC3=CC=CC=C32)S(=O)(=O)C4=CC(=C(C=C4)F)Cl

InChI

InChI=1S/C19H17ClFN3O4S/c20-15-11-13(5-6-16(15)21)29(26,27)24-9-7-23(8-10-24)19(25)12-17-14-3-1-2-4-18(14)28-22-17/h1-6,11H,7-10,12H2