Vitas-M small molecule compound

N-(2,5-dimethoxyphenyl)-5-methyl-1-(3-phenyl-2,1-benzoxazol-5-yl)-1H-1,2,3-triazole-4-carboxamide

Catalog ID
STK731960
SMILES COc1ccc(c(c1)NC(=O)c1nnn(c1C)c1ccc2c(c1)c(on2)c1ccccc1)OC

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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 C25H21N5O4 MW 455.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21N5O4/c1-15-23(25(31)26-21-14-18(32-2)10-12-22(21)33-3)27-29-30(15)17-9-11-20-19(13-17)24(34-28-20)16-7-5-4-6-8-16/h4-14H,1-3H3,(H,26,31)
InChIKey
XLBUSWFGBQBUHE-UHFFFAOYSA-N
Synonyms
951897-31-7
951897317
CC1=C(N=NN1C2=CC3=C(ON=C3C=C2)C4=CC=CC=C4)C(=O)NC5=C(C=CC(=C5)OC)OC
InChI=1SC25H21N5O4c11523(25(31)26211418(322)101222(21)333)272930(15)179112019(1317)24(342820)167546816h414H13H3(H2631)
MFCD10082050
N(25DIMETHOXYPHENYL)(5METHYL1(3PHENYLBENZO(C)ISOXAZOL5YL)(123TRIAZOL4YL))CARBOXAMIDE
N(25dimethoxyphenyl)5methyl1(3phenyl21benzoxazol5yl)1H123triazole4carboxamide
N(25dimethoxyphenyl)5methyl1(3phenyl21benzoxazol5yl)triazole4carboxamide
N(25dimethoxyphenyl)5methyl1(3phenylbenzo(c)isoxazol5yl)1H123triazole4carboxamide
ZINC000012274469
ZINC12274469

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Available files

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