Vitas-M small molecule compound

3-{[(6-chloro-1,3-benzodioxol-5-yl)methyl]sulfanyl}-5H-[1,2,4]triazino[5,6-b]indole

Catalog ID
STK766913
SMILES Clc1cc2OCOc2cc1CSc1nnc2c(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 C17H11ClN4O2S MW 370.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H11ClN4O2S/c18-11-6-14-13(23-8-24-14)5-9(11)7-25-17-20-16-15(21-22-17)10-3-1-2-4-12(10)19-16/h1-6H,7-8H2,(H,19,20,22)
InChIKey
WWCMTHLNRUTLQV-UHFFFAOYSA-N
Synonyms

3(((6chloro13benzodioxol5yl)methyl)sulfanyl)5H(124)triazino(56b)indole
3((6CHLORO13BENZODIOXOL5YL)METHYLSULFANYL)5H(124)TRIAZINO(56B)INDOLE
C1OC2=C(O1)C=C(C(=C2)CSC3=NC4=C(C5=CC=CC=C5N4)N=N3)Cl
Clc1cc2OCOc2cc1CSc1nnc2c(n1)(nH)c1c2cccc1
InChI=1SC17H11ClN4O2Sc181161413(2382414)59(11)72517201615(212217)10312412(10)1916h16H78H2(H192022)
MFCD03018075
ZINC000004451271
ZINC04451271
ZINC4451271

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Available files

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