Vitas-M small molecule compound
4-(3-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-4-nitrophenyl)-N,N-dimethylpiperazine-1-sulfonamide
Catalog ID
STK148625
SMILES COc1cc(CCNc2cc(ccc2[N+](=O)[O-])N2CCN(CC2)S(=O)(=O)N(C)C)ccc1OC
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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 C22H31N5O6S MW 493.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H31N5O6S/c1-24(2)34(30,31)26-13-11-25(12-14-26)18-6-7-20(27(28)29)19(16-18)23-10-9-17-5-8-21(32-3)22(15-17)33-4/h5-8,15-16,23H,9-14H2,1-4H3InChIKey
GDISEYPTUOFNQX-UHFFFAOYSA-NSynonyms
4(3((2(34DIMETHOXYPHENYL)ETHYL)AMINO)4NITROPHENYL)NNDIMETHYLPIPERAZINE1SULFONAMIDE
4(3(2(34DIMETHOXYPHENYL)ETHYLAMINO)4NITROPHENYL)NNDIMETHYLPIPERAZINE1SULFONAMIDE
CN(C)S(=O)(=O)N1CCN(CC1)C2=CC(=C(C=C2)(N+)(=O)(O))NCCC3=CC(=C(C=C3)OC)OC
COc1cc(CCNc2cc(ccc2(N+)(=O)(O))N2CCN(CC2)S(=O)(=O)N(C)C)ccc1OC
InChI=1SC22H31N5O6Sc124(2)34(3031)26131125(121426)186720(27(28)29)19(1618)23109175821(323)22(1517)334h58151623H914H214H3
MFCD02104225
ZINC000009010396
ZINC09010396
ZINC9010396
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