Vitas-M small molecule compound
2-{4-[(1,5-dimethyl-1H-pyrazol-4-yl)sulfonyl]piperazin-1-yl}-N-(4-methoxy-2-nitrophenyl)acetamide
Catalog ID
STL395869
SMILES COc1ccc(c(c1)[N+](=O)[O-])NC(=O)CN1CCN(CC1)S(=O)(=O)c1cnn(c1C)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 C18H24N6O6S MW 452.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H24N6O6S/c1-13-17(11-19-21(13)2)31(28,29)23-8-6-22(7-9-23)12-18(25)20-15-5-4-14(30-3)10-16(15)24(26)27/h4-5,10-11H,6-9,12H2,1-3H3,(H,20,25)InChIKey
PCMXZNARNAZROF-UHFFFAOYSA-NSynonyms
1005638-33-41005638334
2(4((15DIMETHYL1HPYRAZOL4YL)SULFONYL)PIPERAZIN1YL)N(4METHOXY2NITROPHENYL)ACETAMIDE
2(4(15dimethylpyrazol4yl)sulfonylpiperazin1yl)N(4methoxy2nitrophenyl)acetamide
CC1=C(C=NN1C)S(=O)(=O)N2CCN(CC2)CC(=O)NC3=C(C=C(C=C3)OC)(N+)(=O)(O)
COc1ccc(c(c1)(N+)(=O)(O))NC(=O)CN1CCN(CC1)S(=O)(=O)c1cnn(c1C)C
InChI=1SC18H24N6O6Sc11317(111921(13)2)31(2829)238622(7923)1218(25)20155414(303)1016(15)24(26)27h451011H6912H213H3(H2025)
MFCD04140567
ZINC000022533345
ZINC22533345
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