Vitas-M small molecule compound

2-cycloheptyl-8-[3-(methylsulfanyl)-1H-1,2,4-triazol-5-yl]pyrido[4,3-b][1,6]naphthyridine-1,9(2H,8H)-dione

Catalog ID
STL121889
SMILES CSc1n[nH]c(n1)n1ccc2c(c1=O)cc1c(n2)ccn(c1=O)C1CCCCCC1

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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 C21H22N6O2S MW 422.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N6O2S/c1-30-21-23-20(24-25-21)27-11-9-17-15(19(27)29)12-14-16(22-17)8-10-26(18(14)28)13-6-4-2-3-5-7-13/h8-13H,2-7H2,1H3,(H,23,24,25)
InChIKey
CAIOPKZYFORPKD-UHFFFAOYSA-N
Synonyms

2cycloheptyl8(3(methylsulfanyl)1H124triazol5yl)pyrido(43b)(16)naphthyridine19(2H8H)dione
8cycloheptyl2(3methylsulfanyl1H124triazol5yl)pyrido(43b)(16)naphthyridine19dione
CSC1=NNC(=N1)N2C=CC3=NC4=C(C=C3C2=O)C(=O)N(C=C4)C5CCCCCC5
CSc1n(nH)c(n1)n1ccc2c(c1=O)cc1c(n2)ccn(c1=O)C1CCCCCC1
InChI=1SC21H22N6O2Sc130212320(242521)271191715(19(27)29)121416(2217)81026(18(14)28)1364235713h813H27H21H3(H232425)
MFCD15198771
ZINC000040398861
ZINC40398861

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Available files

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