Vitas-M small molecule compound

N-(5-chloro-2-methoxyphenyl)-2-[(5,9-dimethyl[1,2,4]triazolo[4,3-a]quinolin-1-yl)sulfanyl]acetamide

Catalog ID
STL185986
SMILES COc1ccc(cc1NC(=O)CSc1nnc2n1c1c(C)cccc1c(c2)C)Cl

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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 C21H19ClN4O2S MW 426.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19ClN4O2S/c1-12-5-4-6-15-13(2)9-18-24-25-21(26(18)20(12)15)29-11-19(27)23-16-10-14(22)7-8-17(16)28-3/h4-10H,11H2,1-3H3,(H,23,27)
InChIKey
UCQFQZZOWFDMDL-UHFFFAOYSA-N
Synonyms

2(59DIMETHYL(10HYDRO124TRIAZOLO(43A)QUINOLINYLTHIO))N(5CHLORO2METHOXYPHENYL)ACETAMIDE
CC1=CC=CC2=C1N3C(=NN=C3SCC(=O)NC4=C(C=CC(=C4)Cl)OC)C=C2C
InChI=1SC21H19ClN4O2Sc1125461513(2)918242521(26(18)20(12)15)291119(27)23161014(22)7817(16)283h410H11H213H3(H2327)
MFCD09058080
N(5chloro2methoxyphenyl)2((59dimethyl(124)triazolo(43a)quinolin1yl)sulfanyl)acetamide
ZINC000011907888
ZINC11907888

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.