Vitas-M small molecule compound
3-[(4-nitrobenzyl)sulfanyl]-5H-[1,2,4]triazino[5,6-b]indole
Catalog ID
STK508763
SMILES [O-][N+](=O)c1ccc(cc1)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 C16H11N5O2S MW 337.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H11N5O2S/c22-21(23)11-7-5-10(6-8-11)9-24-16-18-15-14(19-20-16)12-3-1-2-4-13(12)17-15/h1-8H,9H2,(H,17,18,20)InChIKey
LBEULDKEQQDTAD-UHFFFAOYSA-NSynonyms
330551-74-1(O)(N+)(=O)c1ccc(cc1)CSc1nnc2c(n1)(nH)c1c2cccc1
3((4nitrobenzyl)sulfanyl)5H(124)triazino(56b)indole
3((4nitrobenzyl)thio)5H(124)triazino(56b)indole
3((4NITROPHENYL)METHYLSULFANYL)5H(124)TRIAZINO(56B)INDOLE
3((4NITROPHENYL)METHYLTHIO)124TRIAZINO(56B)INDOLE
330551741
C1=CC=C2C(=C1)C3=C(N2)N=C(N=N3)SCC4=CC=C(C=C4)(N+)(=O)(O)
InChI=1SC16H11N5O2Sc2221(23)117510(6811)92416181514(192016)12312413(12)1715h18H9H2(H171820)
MFCD01413798
ZINC000005731718
ZINC05731718
ZINC5731718
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