Vitas-M small molecule compound
N-[1-(2-chloro-6-fluorobenzyl)-1H-pyrazol-3-yl]-5-[2-(4-chloro-3-nitro-1H-pyrazol-1-yl)ethyl]-1,3,4-thiadiazol-2-amine
Catalog ID
STL401505
SMILES Fc1cccc(c1Cn1ccc(n1)Nc1nnc(s1)CCn1nc(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 C17H13Cl2FN8O2S MW 483.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H13Cl2FN8O2S/c18-11-2-1-3-13(20)10(11)8-26-6-4-14(24-26)21-17-23-22-15(31-17)5-7-27-9-12(19)16(25-27)28(29)30/h1-4,6,9H,5,7-8H2,(H,21,23,24)InChIKey
ABWGKHVOYFBEFV-UHFFFAOYSA-NSynonyms
1005576-21-51005576215
C1=CC(=C(C(=C1)Cl)CN2C=CC(=N2)NC3=NN=C(S3)CCN4C=C(C(=N4)(N+)(=O)(O))Cl)F
Fc1cccc(c1Cn1ccc(n1)Nc1nnc(s1)CCn1nc(c(c1)Cl)(N+)(=O)(O))Cl
InChI=1SC17H13Cl2FN8O2Sc181121313(20)10(11)8266414(2426)2117232215(3117)5727912(19)16(2527)28(29)30h1469H578H2(H212324)
MFCD04140612
N(1((2chloro6fluorophenyl)methyl)pyrazol3yl)5(2(4chloro3nitropyrazol1yl)ethyl)134thiadiazol2amine
N(1(2chloro6fluorobenzyl)1Hpyrazol3yl)5(2(4chloro3nitro1Hpyrazol1yl)ethyl)134thiadiazol2amine
ZINC000002731427
ZINC02731427
ZINC2731427
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