Vitas-M small molecule compound
N-[1-(2-chlorobenzyl)-1H-pyrazol-3-yl]-5-[2-(4-nitro-1H-pyrazol-1-yl)propan-2-yl]-1,3,4-thiadiazol-2-amine
Catalog ID
STK311906
SMILES Clc1ccccc1Cn1ccc(n1)Nc1nnc(s1)C(n1ncc(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/c1-18(2,26-11-13(9-20-26)27(28)29)16-22-23-17(30-16)21-15-7-8-25(24-15)10-12-5-3-4-6-14(12)19/h3-9,11H,10H2,1-2H3,(H,21,23,24)InChIKey
XDLVCVWQJNFSJD-UHFFFAOYSA-NSynonyms
1005637-70-61005637706
CC(C)(C1=NN=C(S1)NC2=NN(C=C2)CC3=CC=CC=C3Cl)N4C=C(C=N4)(N+)(=O)(O)
Clc1ccccc1Cn1ccc(n1)Nc1nnc(s1)C(n1ncc(c1)(N+)(=O)(O))(C)C
InChI=1SC18H17ClN8O2Sc118(2261113(92026)27(28)29)16222317(3016)21157825(2415)1012534614(12)19h3911H10H212H3(H212324)
MFCD04140330
N(1((2chlorophenyl)methyl)pyrazol3yl)5(2(4nitropyrazol1yl)propan2yl)134thiadiazol2amine
N(1(2chlorobenzyl)1Hpyrazol3yl)5(2(4nitro1Hpyrazol1yl)propan2yl)134thiadiazol2amine
ZINC000002731134
ZINC02731134
ZINC2731134
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