Vitas-M small molecule compound
N-(4-chloro-3-nitrophenyl)-2-[(5-{4-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]phenyl}-4-ethyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide
Catalog ID
STK434193
SMILES CCn1c(SCC(=O)Nc2ccc(c(c2)[N+](=O)[O-])Cl)nnc1c1ccc(cc1)Cn1nc(c(c1C)[N+](=O)[O-])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 C24H23ClN8O5S MW 571.02 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H23ClN8O5S/c1-4-30-23(17-7-5-16(6-8-17)12-31-15(3)22(33(37)38)14(2)29-31)27-28-24(30)39-13-21(34)26-18-9-10-19(25)20(11-18)32(35)36/h5-11H,4,12-13H2,1-3H3,(H,26,34)InChIKey
ZKCOGZWVEOPFAB-UHFFFAOYSA-NSynonyms
2(5(4((35DIMETHYL4NITROPYRAZOLYL)METHYL)PHENYL)4ETHYL(124TRIAZOL3YLTHIO))N(4CHLORO3NITROPHENYL)ACETAMIDE
CCN1C(=NN=C1SCC(=O)NC2=CC(=C(C=C2)Cl)(N+)(=O)(O))C3=CC=C(C=C3)CN4C(=C(C(=N4)C)(N+)(=O)(O))C
CCn1c(SCC(=O)Nc2ccc(c(c2)(N+)(=O)(O))Cl)nnc1c1ccc(cc1)Cn1nc(c(c1C)(N+)(=O)(O))C
InChI=1SC24H23ClN8O5Sc143023(177516(6817)123115(3)22(33(37)38)14(2)2931)272824(30)391321(34)261891019(25)20(1118)32(35)36h511H41213H213H3(H2634)
MFCD03942988
N(4chloro3nitrophenyl)2((5(4((35dimethyl4nitro1Hpyrazol1yl)methyl)phenyl)4ethyl4H124triazol3yl)sulfanyl)acetamide
N(4CHLORO3NITROPHENYL)2((5(4((35DIMETHYL4NITROPYRAZOL1YL)METHYL)PHENYL)4ETHYL124TRIAZOL3YL)SULFANYL)ACETAMIDE
ZINC000102216666
ZINC102216666
Check stock
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Check stock on Vitas-MAvailable files
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