Vitas-M small molecule compound
N-[1-(2-chloro-6-fluorobenzyl)-1H-pyrazol-3-yl]-5-[(4-chloro-3-nitro-1H-pyrazol-1-yl)methyl]-1,3,4-thiadiazol-2-amine
Catalog ID
STL403785
SMILES Fc1cccc(c1Cn1ccc(n1)Nc1nnc(s1)Cn1nc(c(c1)Cl)[N+](=O)[O-])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 C16H11Cl2FN8O2S MW 469.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H11Cl2FN8O2S/c17-10-2-1-3-12(19)9(10)6-25-5-4-13(23-25)20-16-22-21-14(30-16)8-26-7-11(18)15(24-26)27(28)29/h1-5,7H,6,8H2,(H,20,22,23)InChIKey
NRCPDNCBBPXSMG-UHFFFAOYSA-NSynonyms
1005571-29-81005571298
C1=CC(=C(C(=C1)Cl)CN2C=CC(=N2)NC3=NN=C(S3)CN4C=C(C(=N4)(N+)(=O)(O))Cl)F
Fc1cccc(c1Cn1ccc(n1)Nc1nnc(s1)Cn1nc(c(c1)Cl)(N+)(=O)(O))Cl
InChI=1SC16H11Cl2FN8O2Sc171021312(19)9(10)6255413(2325)2016222114(3016)826711(18)15(2426)27(28)29h157H68H2(H202223)
MFCD04137707
N(1((2chloro6fluorophenyl)methyl)pyrazol3yl)5((4chloro3nitropyrazol1yl)methyl)134thiadiazol2amine
N(1(2chloro6fluorobenzyl)1Hpyrazol3yl)5((4chloro3nitro1Hpyrazol1yl)methyl)134thiadiazol2amine
ZINC000002809198
ZINC02809198
ZINC2809198
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