Vitas-M small molecule compound

7-(1,3-benzothiazol-2-yl)-2-[(4-methoxyphenoxy)methyl]-8,9-dimethyl-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine

Catalog ID
STK627465
SMILES COc1ccc(cc1)OCc1nn2c(n1)c1c(nc2)n(c(c1C)C)c1nc2c(s1)cccc2

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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 C24H20N6O2S MW 456.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H20N6O2S/c1-14-15(2)30(24-26-18-6-4-5-7-19(18)33-24)22-21(14)23-27-20(28-29(23)13-25-22)12-32-17-10-8-16(31-3)9-11-17/h4-11,13H,12H2,1-3H3
InChIKey
NCIHKJOVJSMLNP-UHFFFAOYSA-N
Synonyms
920449-09-8
2(2((4methoxyphenoxy)methyl)89dimethyl7Hpyrrolo(32e)(124)triazolo(15c)pyrimidin7yl)benzo(d)thiazole
7(13benzothiazol2yl)2((4methoxyphenoxy)methyl)89dimethyl7Hpyrrolo(32e)(124)triazolo(15c)pyrimidine
920449098
CC1=C(N(C2=C1C3=NC(=NN3C=N2)COC4=CC=C(C=C4)OC)C5=NC6=CC=CC=C6S5)C
InChI=1SC24H20N6O2Sc11415(2)30(242618645719(18)3324)2221(14)232720(2829(23)132522)12321710816(313)91117h41113H12H213H3
MFCD08747893
ZINC000009306766
ZINC09306766
ZINC9306766

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Available files

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