Vitas-M small molecule compound
5-{4-[(4-methylphenyl)sulfonyl]piperazin-1-yl}-2-nitro-N-(prop-2-en-1-yl)aniline
Catalog ID
STK157487
SMILES C=CCNc1cc(ccc1[N+](=O)[O-])N1CCN(CC1)S(=O)(=O)c1ccc(cc1)C
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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 C20H24N4O4S MW 416.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H24N4O4S/c1-3-10-21-19-15-17(6-9-20(19)24(25)26)22-11-13-23(14-12-22)29(27,28)18-7-4-16(2)5-8-18/h3-9,15,21H,1,10-14H2,2H3InChIKey
VXOUMAIGJXWXGB-UHFFFAOYSA-NSynonyms
5(4((4METHYLPHENYL)SULFONYL)PIPERAZIN1YL)2NITRON(PROP2EN1YL)ANILINE
5(4(4METHYLPHENYL)SULFONYLPIPERAZIN1YL)2NITRONPROP2ENYLANILINE
C=CCNc1cc(ccc1(N+)(=O)(O))N1CCN(CC1)S(=O)(=O)c1ccc(cc1)C
CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=CC(=C(C=C3)(N+)(=O)(O))NCC=C
InChI=1SC20H24N4O4Sc131021191517(6920(19)24(25)26)22111323(141222)29(2728)187416(2)5818h391521H11014H22H3
MFCD03614904
ZINC000004688171
ZINC04688171
ZINC4688171
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