Vitas-M small molecule compound
1-{3-[(furan-2-ylmethyl)sulfanyl]-4-nitrophenyl}-4-[(4-methylphenyl)sulfonyl]piperazine
Catalog ID
STK053844
SMILES Cc1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(c(c1)SCc1ccco1)[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 C22H23N3O5S2 MW 473.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23N3O5S2/c1-17-4-7-20(8-5-17)32(28,29)24-12-10-23(11-13-24)18-6-9-21(25(26)27)22(15-18)31-16-19-3-2-14-30-19/h2-9,14-15H,10-13,16H2,1H3InChIKey
OTYYQQJBIFFTEI-UHFFFAOYSA-NSynonyms
1(3((FURAN2YLMETHYL)SULFANYL)4NITROPHENYL)4((4METHYLPHENYL)SULFONYL)PIPERAZINE
1(3(FURAN2YLMETHYLSULFANYL)4NITROPHENYL)4(4METHYLPHENYL)SULFONYLPIPERAZINE
CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=CC(=C(C=C3)(N+)(=O)(O))SCC4=CC=CO4
Cc1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(c(c1)SCc1ccco1)(N+)(=O)(O)
InChI=1SC22H23N3O5S2c1174720(8517)32(2829)24121023(111324)186921(25(26)27)22(1518)31161932143019h291415H101316H21H3
MFCD03146371
STK053844
ZINC000009434930
ZINC09434930
ZINC9434930
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