Vitas-M small molecule compound
2-benzyl-8-[3-(methylsulfanyl)-1H-1,2,4-triazol-5-yl]pyrido[4,3-b][1,6]naphthyridine-1,9(2H,8H)-dione
Catalog ID
STL121891
SMILES CSc1n[nH]c(n1)n1ccc2c(c1=O)cc1c(n2)ccn(c1=O)Cc1ccccc1
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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 C21H16N6O2S MW 416.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16N6O2S/c1-30-21-23-20(24-25-21)27-10-8-17-15(19(27)29)11-14-16(22-17)7-9-26(18(14)28)12-13-5-3-2-4-6-13/h2-11H,12H2,1H3,(H,23,24,25)InChIKey
JKGLKXQXURQZGT-UHFFFAOYSA-NSynonyms
2benzyl8(3(methylsulfanyl)1H124triazol5yl)pyrido(43b)(16)naphthyridine19(2H8H)dione
8benzyl2(3methylsulfanyl1H124triazol5yl)pyrido(43b)(16)naphthyridine19dione
CSC1=NNC(=N1)N2C=CC3=NC4=C(C=C3C2=O)C(=O)N(C=C4)CC5=CC=CC=C5
CSc1n(nH)c(n1)n1ccc2c(c1=O)cc1c(n2)ccn(c1=O)Cc1ccccc1
InChI=1SC21H16N6O2Sc130212320(242521)271081715(19(27)29)111416(2217)7926(18(14)28)12135324613h211H12H21H3(H232425)
MFCD15198782
ZINC000040398878
ZINC40398878
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