Vitas-M small molecule compound
8-methoxy-N-[3-(methylsulfanyl)-1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)propyl]-4-oxo-1,4-dihydroquinoline-3-carboxamide
Catalog ID
STL422510
SMILES CSCCC(c1nnc2n1cccc2)NC(=O)c1c[nH]c2c(c1=O)cccc2OC
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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 C21H21N5O3S MW 423.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N5O3S/c1-29-16-7-5-6-13-18(16)22-12-14(19(13)27)21(28)23-15(9-11-30-2)20-25-24-17-8-3-4-10-26(17)20/h3-8,10,12,15H,9,11H2,1-2H3,(H,22,27)(H,23,28)InChIKey
URJRPMIGJXNTFH-UHFFFAOYSA-NSynonyms
8methoxyN(3(methylsulfanyl)1((124)triazolo(43a)pyridin3yl)propyl)4oxo14dihydroquinoline3carboxamide
8methoxyN(3methylsulfanyl1((124)triazolo(43a)pyridin3yl)propyl)4oxo1Hquinoline3carboxamide
COC1=CC=CC2=C1NC=C(C2=O)C(=O)NC(CCSC)C3=NN=C4N3C=CC=C4
CSCCC(c1nnc2n1cccc2)NC(=O)c1c(nH)c2c(c1=O)cccc2OC
InChI=1SC21H21N5O3Sc129167561318(16)221214(19(13)27)21(28)2315(911302)202524178341026(17)20h38101215H911H212H3(H2227)(H2328)
MFCD30708199
ZINC000218269269
ZINC000253496400
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