Vitas-M small molecule compound
N-[1-(2-chloro-4-fluorobenzyl)-1H-1,2,4-triazol-3-yl]-1,3-benzodioxole-5-carboxamide
Catalog ID
STK308963
SMILES Fc1ccc(c(c1)Cl)Cn1cnc(n1)NC(=O)c1ccc2c(c1)OCO2
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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 C17H12ClFN4O3 MW 374.76 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H12ClFN4O3/c18-13-6-12(19)3-1-11(13)7-23-8-20-17(22-23)21-16(24)10-2-4-14-15(5-10)26-9-25-14/h1-6,8H,7,9H2,(H,21,22,24)InChIKey
PRXCNRKWJFYIPX-UHFFFAOYSA-NSynonyms
828299-08-7828299087
C1OC2=C(O1)C=C(C=C2)C(=O)NC3=NN(C=N3)CC4=C(C=C(C=C4)F)Cl
InChI=1SC17H12ClFN4O3c1813612(19)3111(13)72382017(2223)2116(24)10241415(510)2692514h168H79H2(H212224)
MFCD04133082
N(1((2CHLORO4FLUOROPHENYL)METHYL)124TRIAZOL3YL)13BENZODIOXOLE5CARBOXAMIDE
N(1(2chloro4fluorobenzyl)1H124triazol3yl)13benzodioxole5carboxamide
ZINC000002798883
ZINC02798883
ZINC2798883
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