Vitas-M small molecule compound

3-[(3-bromo-4-methoxybenzyl)sulfanyl]-5H-[1,2,4]triazino[5,6-b]indole

Catalog ID
STK779269
SMILES COc1ccc(cc1Br)CSc1nnc2c(n1)[nH]c1c2cccc1

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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 C17H13BrN4OS MW 401.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H13BrN4OS/c1-23-14-7-6-10(8-12(14)18)9-24-17-20-16-15(21-22-17)11-4-2-3-5-13(11)19-16/h2-8H,9H2,1H3,(H,19,20,22)
InChIKey
PFGGTYISKPDJFZ-UHFFFAOYSA-N
Synonyms

3((3bromo4methoxybenzyl)sulfanyl)5H(124)triazino(56b)indole
3((3BROMO4METHOXYPHENYL)METHYLSULFANYL)5H(124)TRIAZINO(56B)INDOLE
COC1=C(C=C(C=C1)CSC2=NC3=C(C4=CC=CC=C4N3)N=N2)Br
COc1ccc(cc1Br)CSc1nnc2c(n1)(nH)c1c2cccc1
InChI=1SC17H13BrN4OSc123147610(812(14)18)92417201615(212217)11423513(11)1916h28H9H21H3(H192022)
MFCD05858292
ZINC000001429233
ZINC01429233
ZINC1429233

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Available files

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