Vitas-M small molecule compound
N-[1-(3-chlorobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]-1,3-benzodioxole-5-carboxamide
Catalog ID
STK309252
SMILES Clc1cccc(c1)Cn1nc(c(c1C)NC(=O)c1ccc2c(c1)OCO2)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 C20H18ClN3O3 MW 383.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18ClN3O3/c1-12-19(13(2)24(23-12)10-14-4-3-5-16(21)8-14)22-20(25)15-6-7-17-18(9-15)27-11-26-17/h3-9H,10-11H2,1-2H3,(H,22,25)InChIKey
KRGOMAXJFCCIEU-UHFFFAOYSA-NSynonyms
942818-91-9942818919
CC1=C(C(=NN1CC2=CC(=CC=C2)Cl)C)NC(=O)C3=CC4=C(C=C3)OCO4
InChI=1SC20H18ClN3O3c11219(13(2)24(2312)101443516(21)814)2220(25)15671718(915)27112617h39H1011H212H3(H2225)
MFCD04133746
N(1((3CHLOROPHENYL)METHYL)35DIMETHYLPYRAZOL4YL)13BENZODIOXOLE5CARBOXAMIDE
N(1(3chlorobenzyl)35dimethyl1Hpyrazol4yl)13benzodioxole5carboxamide
ZINC000002800168
ZINC02800168
ZINC2800168
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