Vitas-M small molecule compound
2-{[5-(5-chloro-2-methoxyphenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-chloropyridin-3-yl)acetamide
Catalog ID
STK469727
SMILES COc1ccc(cc1c1nnc(n1CC)SCC(=O)Nc1cccnc1Cl)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 C18H17Cl2N5O2S MW 438.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17Cl2N5O2S/c1-3-25-17(12-9-11(19)6-7-14(12)27-2)23-24-18(25)28-10-15(26)22-13-5-4-8-21-16(13)20/h4-9H,3,10H2,1-2H3,(H,22,26)InChIKey
HHKMQBNSLHNFES-UHFFFAOYSA-NSynonyms
2((5(5chloro2methoxyphenyl)4ethyl124triazol3yl)sulfanyl)N(2chloropyridin3yl)acetamide
2((5(5chloro2methoxyphenyl)4ethyl4H124triazol3yl)sulfanyl)N(2chloropyridin3yl)acetamide
CCN1C(=NN=C1SCC(=O)NC2=C(N=CC=C2)Cl)C3=C(C=CC(=C3)Cl)OC
InChI=1SC18H17Cl2N5O2Sc132517(12911(19)6714(12)272)232418(25)281015(26)22135482116(13)20h49H310H212H3(H2226)
MFCD07078943
N(2CHLORO(3PYRIDYL))2(5(5CHLORO2METHOXYPHENYL)4ETHYL(124TRIAZOL3YLTHIO))ACETAMIDE
ZINC000017101943
ZINC17101943
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