Vitas-M small molecule compound

5,8-diethyl-5H-[1,2,4]triazino[5,6-b]indole-3-thiol

Catalog ID
STK109370
SMILES CCc1ccc2c(c1)c1nnc(nc1n2CC)S

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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 C13H14N4S MW 258.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H14N4S/c1-3-8-5-6-10-9(7-8)11-12(17(10)4-2)14-13(18)16-15-11/h5-7H,3-4H2,1-2H3,(H,14,16,18)
InChIKey
LINIQQGWMWSICD-UHFFFAOYSA-N
Synonyms
736968-36-8
58DIETHYL124TRIAZINO(56B)INDOLE3THIOL
58DIETHYL2H(124)TRIAZINO(56B)INDOLE3THIONE
58DIETHYL5H(124)TRIAZINO(56B)INDOLE3THIOL
736968368
CCC1=CC2=C(C=C1)N(C3=NC(=S)NN=C23)CC
InChI=1SC13H14N4Sc13856109(78)1112(17(10)42)1413(18)161511h57H34H212H3(H141618)
MFCD04005755
ZINC000005823291
ZINC5823291

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.