Vitas-M small molecule compound
N-[1-(2-chlorobenzyl)-1H-pyrazol-3-yl]-5-[1-(3-methyl-4-nitro-1H-pyrazol-1-yl)ethyl]-1,3,4-thiadiazol-2-amine
Catalog ID
STL400907
SMILES Clc1ccccc1Cn1ccc(n1)Nc1nnc(s1)C(n1nc(c(c1)[N+](=O)[O-])C)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/c1-11-15(27(28)29)10-26(23-11)12(2)17-21-22-18(30-17)20-16-7-8-25(24-16)9-13-5-3-4-6-14(13)19/h3-8,10,12H,9H2,1-2H3,(H,20,22,24)InChIKey
SRZFAVIQPVJXND-UHFFFAOYSA-NSynonyms
1005611-56-21005611562
CC1=NN(C=C1(N+)(=O)(O))C(C)C2=NN=C(S2)NC3=NN(C=C3)CC4=CC=CC=C4Cl
Clc1ccccc1Cn1ccc(n1)Nc1nnc(s1)C(n1nc(c(c1)(N+)(=O)(O))C)C
InChI=1SC18H17ClN8O2Sc11115(27(28)29)1026(2311)12(2)17212218(3017)20167825(2416)913534614(13)19h381012H9H212H3(H202224)
MFCD04140779
N(1((2chlorophenyl)methyl)pyrazol3yl)5(1(3methyl4nitropyrazol1yl)ethyl)134thiadiazol2amine
N(1(2chlorobenzyl)1Hpyrazol3yl)5(1(3methyl4nitro1Hpyrazol1yl)ethyl)134thiadiazol2amine
ZINC000002731620
ZINC000002731621
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