Vitas-M small molecule compound
(2E)-N-[1-(3-fluorobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]-3-[3-methoxy-4-(propan-2-yloxy)phenyl]prop-2-enamide
Catalog ID
STK443213
SMILES COc1cc(/C=C/C(=O)Nc2c(C)nn(c2C)Cc2cccc(c2)F)ccc1OC(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 C25H28FN3O3 MW 437.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H28FN3O3/c1-16(2)32-22-11-9-19(14-23(22)31-5)10-12-24(30)27-25-17(3)28-29(18(25)4)15-20-7-6-8-21(26)13-20/h6-14,16H,15H2,1-5H3,(H,27,30)/b12-10+InChIKey
BXHXISSFKLHVJM-ZRDIBKRKSA-NSynonyms
(2E)N(1((3FLUOROPHENYL)METHYL)35DIMETHYLPYRAZOL4YL)3(3METHOXY4(METHYLETHOXY)PHENYL)PROP2ENAMIDE
(2E)N(1(3fluorobenzyl)35dimethyl1Hpyrazol4yl)3(3methoxy4(propan2yloxy)phenyl)prop2enamide
(E)N(1((3fluorophenyl)methyl)35dimethylpyrazol4yl)3(3methoxy4propan2yloxyphenyl)prop2enamide
CC1=C(C(=NN1CC2=CC(=CC=C2)F)C)NC(=O)C=CC3=CC(=C(C=C3)OC(C)C)OC
COc1cc(C=CC(=O)Nc2c(C)nn(c2C)Cc2cccc(c2)F)ccc1OC(C)C
InChI=1SC25H28FN3O3c116(2)322211919(1423(22)315)101224(30)272517(3)2829(18(25)4)152076821(26)1320h61416H15H215H3(H2730)b1210+
MFCD04054712
ZINC000017101425
ZINC17101425
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