Vitas-M small molecule compound
2-[3-(ethylsulfanyl)-1H-1,2,4-triazol-5-yl]-8-phenylpyrido[4,3-b][1,6]naphthyridine-1,9(2H,8H)-dione
Catalog ID
STL121898
SMILES CCSc1n[nH]c(n1)n1ccc2c(c1=O)cc1c(n2)ccn(c1=O)c1ccccc1
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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/c1-2-30-21-23-20(24-25-21)27-11-9-17-15(19(27)29)12-14-16(22-17)8-10-26(18(14)28)13-6-4-3-5-7-13/h3-12H,2H2,1H3,(H,23,24,25)InChIKey
BHCTUZJFTRSGON-UHFFFAOYSA-NSynonyms
2(3(ethylsulfanyl)1H124triazol5yl)8phenylpyrido(43b)(16)naphthyridine19(2H8H)dione
2(3ethylsulfanyl1H124triazol5yl)8phenylpyrido(43b)(16)naphthyridine19dione
CCSC1=NNC(=N1)N2C=CC3=C(C2=O)C=C4C(=N3)C=CN(C4=O)C5=CC=CC=C5
CCSc1n(nH)c(n1)n1ccc2c(c1=O)cc1c(n2)ccn(c1=O)c1ccccc1
InChI=1SC21H16N6O2Sc1230212320(242521)271191715(19(27)29)121416(2217)81026(18(14)28)136435713h312H2H21H3(H232425)
MFCD15198829
ZINC000040398932
ZINC40398932
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