Vitas-M small molecule compound
2-nitro-N-(4-phenylbutan-2-yl)-5-[4-(phenylsulfonyl)piperazin-1-yl]aniline
Catalog ID
STK148665
SMILES CC(Nc1cc(ccc1[N+](=O)[O-])N1CCN(CC1)S(=O)(=O)c1ccccc1)CCc1ccccc1
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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 C26H30N4O4S MW 494.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H30N4O4S/c1-21(12-13-22-8-4-2-5-9-22)27-25-20-23(14-15-26(25)30(31)32)28-16-18-29(19-17-28)35(33,34)24-10-6-3-7-11-24/h2-11,14-15,20-21,27H,12-13,16-19H2,1H3InChIKey
MONNMTHQEWTYCC-UHFFFAOYSA-NSynonyms
2NITRON(4PHENYLBUTAN2YL)5(4(PHENYLSULFONYL)PIPERAZIN1YL)ANILINE
4(3((1METHYL3PHENYLPROPYL)AMINO)4NITROPHENYL)1(PHENYLSULFONYL)PIPERAZINE
5(4(BENZENESULFONYL)PIPERAZIN1YL)2NITRON(4PHENYLBUTAN2YL)ANILINE
CC(CCC1=CC=CC=C1)NC2=C(C=CC(=C2)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4)(N+)(=O)(O)
CC(Nc1cc(ccc1(N+)(=O)(O))N1CCN(CC1)S(=O)(=O)c1ccccc1)CCc1ccccc1
InChI=1SC26H30N4O4Sc121(1213228425922)27252023(141526(25)30(31)32)28161829(191728)35(3334)24106371124h2111415202127H12131619H21H3
MFCD02219047
ZINC000008781018
ZINC000008781215
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