Vitas-M small molecule compound
N-[1-(2-chlorobenzyl)-1H-pyrazol-3-yl]-5-[2-(3-methyl-4-nitro-1H-pyrazol-1-yl)ethyl]-1,3,4-thiadiazol-2-amine
Catalog ID
STK311827
SMILES Clc1ccccc1Cn1ccc(n1)Nc1nnc(s1)CCn1nc(c(c1)[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 C18H17ClN8O2S MW 444.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17ClN8O2S/c1-12-15(27(28)29)11-26(23-12)9-7-17-21-22-18(30-17)20-16-6-8-25(24-16)10-13-4-2-3-5-14(13)19/h2-6,8,11H,7,9-10H2,1H3,(H,20,22,24)InChIKey
VNUYXPMISGYNHQ-UHFFFAOYSA-NSynonyms
1005572-95-11005572951
CC1=NN(C=C1(N+)(=O)(O))CCC2=NN=C(S2)NC3=NN(C=C3)CC4=CC=CC=C4Cl
Clc1ccccc1Cn1ccc(n1)Nc1nnc(s1)CCn1nc(c(c1)(N+)(=O)(O))C
InChI=1SC18H17ClN8O2Sc11215(27(28)29)1126(2312)9717212218(3017)20166825(2416)1013423514(13)19h26811H7910H21H3(H202224)
MFCD04140136
N(1((2chlorophenyl)methyl)pyrazol3yl)5(2(3methyl4nitropyrazol1yl)ethyl)134thiadiazol2amine
N(1(2chlorobenzyl)1Hpyrazol3yl)5(2(3methyl4nitro1Hpyrazol1yl)ethyl)134thiadiazol2amine
ZINC000002730925
ZINC02730925
ZINC2730925
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