Vitas-M small molecule compound
N-[1-(2,6-dichlorobenzyl)-1H-pyrazol-3-yl]-5-[2-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)ethyl]-1,3,4-thiadiazol-2-amine
Catalog ID
STK311859
SMILES Clc1cccc(c1Cn1ccc(n1)Nc1nnc(s1)CCn1nc(c(c1C)[N+](=O)[O-])C)Cl
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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 C19H18Cl2N8O2S MW 493.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18Cl2N8O2S/c1-11-18(29(30)31)12(2)28(25-11)9-7-17-23-24-19(32-17)22-16-6-8-27(26-16)10-13-14(20)4-3-5-15(13)21/h3-6,8H,7,9-10H2,1-2H3,(H,22,24,26)InChIKey
KOYMMJHNMSBALW-UHFFFAOYSA-NSynonyms
1005573-10-31005573103
CC1=C(C(=NN1CCC2=NN=C(S2)NC3=NN(C=C3)CC4=C(C=CC=C4Cl)Cl)C)(N+)(=O)(O)
Clc1cccc(c1Cn1ccc(n1)Nc1nnc(s1)CCn1nc(c(c1C)(N+)(=O)(O))C)Cl
InChI=1SC19H18Cl2N8O2Sc11118(29(30)31)12(2)28(2511)9717232419(3217)22166827(2616)101314(20)43515(13)21h368H7910H212H3(H222426)
MFCD04140215
N(1((26dichlorophenyl)methyl)pyrazol3yl)5(2(35dimethyl4nitropyrazol1yl)ethyl)134thiadiazol2amine
N(1(26dichlorobenzyl)1Hpyrazol3yl)5(2(35dimethyl4nitro1Hpyrazol1yl)ethyl)134thiadiazol2amine
ZINC000002731013
ZINC02731013
ZINC2731013
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