Vitas-M small molecule compound

3-[(2,1,3-benzoxadiazol-5-ylmethyl)sulfanyl]-5-benzyl-5H-[1,2,4]triazino[5,6-b]indole

Catalog ID
STK769448
SMILES c1ccc(cc1)Cn1c2ccccc2c2c1nc(SCc1ccc3c(c1)non3)nn2

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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 C23H16N6OS MW 424.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H16N6OS/c1-2-6-15(7-3-1)13-29-20-9-5-4-8-17(20)21-22(29)24-23(26-25-21)31-14-16-10-11-18-19(12-16)28-30-27-18/h1-12H,13-14H2
InChIKey
UBVOHUWQLLLZKW-UHFFFAOYSA-N
Synonyms

3((213benzoxadiazol5ylmethyl)sulfanyl)5benzyl5H(124)triazino(56b)indole
3(BENZO(C)125OXADIAZOL5YLMETHYLTHIO)5BENZYL124TRIAZINO(56B)INDOLE
5((5BENZYL(124)TRIAZINO(56B)INDOL3YL)SULFANYLMETHYL)213BENZOXADIAZOLE
C1=CC=C(C=C1)CN2C3=CC=CC=C3C4=C2N=C(N=N4)SCC5=CC6=NON=C6C=C5
InChI=1SC23H16N6OSc12615(731)132920954817(20)2122(29)2423(262521)31141610111819(1216)28302718h112H1314H2
MFCD03409108
ZINC000000720896
ZINC00720896
ZINC720896

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Available files

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