Vitas-M small molecule compound
1-[(4-chlorophenyl)sulfonyl]-2-methyl-4-[4-nitro-3-(piperidin-1-yl)phenyl]piperazine
Catalog ID
STK150278
SMILES Clc1ccc(cc1)S(=O)(=O)N1CCN(CC1C)c1ccc(c(c1)N1CCCCC1)[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 C22H27ClN4O4S MW 479.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H27ClN4O4S/c1-17-16-25(13-14-26(17)32(30,31)20-8-5-18(23)6-9-20)19-7-10-21(27(28)29)22(15-19)24-11-3-2-4-12-24/h5-10,15,17H,2-4,11-14,16H2,1H3InChIKey
IPQXOYSDTPFVAA-UHFFFAOYSA-NSynonyms
1((4CHLOROPHENYL)SULFONYL)2METHYL4(4NITRO3(PIPERIDIN1YL)PHENYL)PIPERAZINE
1(4CHLOROPHENYL)SULFONYL2METHYL4(4NITRO3PIPERIDIN1YLPHENYL)PIPERAZINE
CC1CN(CCN1S(=O)(=O)C2=CC=C(C=C2)Cl)C3=CC(=C(C=C3)(N+)(=O)(O))N4CCCCC4
Clc1ccc(cc1)S(=O)(=O)N1CCN(CC1C)c1ccc(c(c1)N1CCCCC1)(N+)(=O)(O)
InChI=1SC22H27ClN4O4Sc1171625(131426(17)32(3031)208518(23)6920)1971021(27(28)29)22(1519)24113241224h5101517H24111416H21H3
MFCD03146360
ZINC000009720448
ZINC000009720449
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