Vitas-M small molecule compound
1-(2-chloro-4-fluorobenzyl)-4-[(3-nitrophenyl)sulfonyl]piperazine
Catalog ID
STL178174
SMILES Fc1ccc(c(c1)Cl)CN1CCN(CC1)S(=O)(=O)c1cccc(c1)[N+](=O)[O-]
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C17H17ClFN3O4S MW 413.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17ClFN3O4S/c18-17-10-14(19)5-4-13(17)12-20-6-8-21(9-7-20)27(25,26)16-3-1-2-15(11-16)22(23)24/h1-5,10-11H,6-9,12H2InChIKey
YBUCHZKSAKLWGT-UHFFFAOYSA-NSynonyms
1((2CHLORO4FLUOROPHENYL)METHYL)4(3NITROPHENYL)SULFONYLPIPERAZINE
1(2chloro4fluorobenzyl)4((3nitrophenyl)sulfonyl)piperazine
C1CN(CCN1CC2=C(C=C(C=C2)F)Cl)S(=O)(=O)C3=CC=CC(=C3)(N+)(=O)(O)
Fc1ccc(c(c1)Cl)CN1CCN(CC1)S(=O)(=O)c1cccc(c1)(N+)(=O)(O)
InChI=1SC17H17ClFN3O4Sc18171014(19)5413(17)12206821(9720)27(2526)1631215(1116)22(23)24h151011H6912H2
MFCD04056085
ZINC000020614104
ZINC20614104
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