Vitas-M small molecule compound

2-[(1,3-benzothiazol-2-ylsulfanyl)methyl]-8,9-dimethyl-7-(6-methylpyridin-2-yl)-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine

Catalog ID
STK945702
SMILES Cc1cccc(n1)n1c2ncn3c(c2c(c1C)C)nc(n3)CSc1nc2c(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 C23H19N7S2 MW 457.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H19N7S2/c1-13-7-6-10-19(25-13)30-15(3)14(2)20-21(30)24-12-29-22(20)27-18(28-29)11-31-23-26-16-8-4-5-9-17(16)32-23/h4-10,12H,11H2,1-3H3
InChIKey
XHHOHUSTRVYYEN-UHFFFAOYSA-N
Synonyms
921160-68-1
2(((89dimethyl7(6methylpyridin2yl)7Hpyrrolo(32e)(124)triazolo(15c)pyrimidin2yl)methyl)thio)benzo(d)thiazole
2((13benzothiazol2ylsulfanyl)methyl)89dimethyl7(6methylpyridin2yl)7Hpyrrolo(32e)(124)triazolo(15c)pyrimidine
921160681
CC1=NC(=CC=C1)N2C(=C(C3=C2N=CN4C3=NC(=N4)CSC5=NC6=CC=CC=C6S5)C)C
InChI=1SC23H19N7S2c113761019(2513)3015(3)14(2)2021(30)24122922(20)2718(2829)1131232616845917(16)3223h41012H11H213H3
MFCD08747935
ZINC000009344013
ZINC09344013
ZINC9344013

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Available files

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