Vitas-M small molecule compound

N-(2,4-dichlorophenyl)-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
STK434183
SMILES CCn1c(SCC(=O)Nc2ccc(cc2Cl)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 C24H23Cl2N7O3S MW 560.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H23Cl2N7O3S/c1-4-31-23(28-29-24(31)37-13-21(34)27-20-10-9-18(25)11-19(20)26)17-7-5-16(6-8-17)12-32-15(3)22(33(35)36)14(2)30-32/h5-11H,4,12-13H2,1-3H3,(H,27,34)
InChIKey
NDBSKXXEXCGVRM-UHFFFAOYSA-N
Synonyms

CCN1C(=NN=C1SCC(=O)NC2=C(C=C(C=C2)Cl)Cl)C3=CC=C(C=C3)CN4C(=C(C(=N4)C)(N+)(=O)(O))C
CCn1c(SCC(=O)Nc2ccc(cc2Cl)Cl)nnc1c1ccc(cc1)Cn1nc(c(c1C)(N+)(=O)(O))C
InChI=1SC24H23Cl2N7O3Sc143123(282924(31)371321(34)272010918(25)1119(20)26)177516(6817)123215(3)22(33(35)36)14(2)3032h511H41213H213H3(H2734)
MFCD03942968
N(24dichlorophenyl)2((5(4((35dimethyl4nitro1Hpyrazol1yl)methyl)phenyl)4ethyl4H124triazol3yl)sulfanyl)acetamide
N(24DICHLOROPHENYL)2((5(4((35DIMETHYL4NITROPYRAZOL1YL)METHYL)PHENYL)4ETHYL124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(24DICHLOROPHENYL)2(5(4((35DIMETHYL4NITROPYRAZOLYL)METHYL)PHENYL)4ETHYL(124TRIAZOL3YLTHIO))ACETAMIDE
ZINC000097948266
ZINC97948266

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Available files

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