Vitas-M small molecule compound
2-(5-{4-[(3,4-dimethoxyphenyl)sulfonyl]piperazin-1-yl}-2-nitrophenyl)-1,2,3,4-tetrahydroisoquinoline
Catalog ID
STK171109
SMILES COc1cc(ccc1OC)S(=O)(=O)N1CCN(CC1)c1ccc(c(c1)N1CCc2c(C1)cccc2)[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 C27H30N4O6S MW 538.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H30N4O6S/c1-36-26-10-8-23(18-27(26)37-2)38(34,35)30-15-13-28(14-16-30)22-7-9-24(31(32)33)25(17-22)29-12-11-20-5-3-4-6-21(20)19-29/h3-10,17-18H,11-16,19H2,1-2H3InChIKey
YNTMZFVAKVUBKY-UHFFFAOYSA-NSynonyms
2(5(4((34dimethoxyphenyl)sulfonyl)piperazin1yl)2nitrophenyl)1234tetrahydroisoquinoline
2(5(4(34DIMETHOXYPHENYL)SULFONYLPIPERAZIN1YL)2NITROPHENYL)34DIHYDRO1HISOQUINOLINE
COC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=CC(=C(C=C3)(N+)(=O)(O))N4CCC5=CC=CC=C5C4)OC
COc1cc(ccc1OC)S(=O)(=O)N1CCN(CC1)c1ccc(c(c1)N1CCc2c(C1)cccc2)(N+)(=O)(O)
InChI=1SC27H30N4O6Sc1362610823(1827(26)372)38(3435)30151328(141630)227924(31(32)33)25(1722)29121120534621(20)1929h3101718H111619H212H3
MFCD04220117
ZINC000059602997
ZINC59602997
Check stock
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Check stock on Vitas-MAvailable files
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