Vitas-M small molecule compound
2-[(4-chlorobenzyl)sulfanyl]-5-[(pyrimidin-2-ylsulfanyl)methyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Catalog ID
STK285126
SMILES Clc1ccc(cc1)CSc1nn2c(n1)[nH]c(cc2=O)CSc1ncccn1
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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 C17H13ClN6OS2 MW 416.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H13ClN6OS2/c18-12-4-2-11(3-5-12)9-26-17-22-15-21-13(8-14(25)24(15)23-17)10-27-16-19-6-1-7-20-16/h1-8H,9-10H2,(H,21,22,23)InChIKey
IFBSEETVJFHQES-UHFFFAOYSA-NSynonyms
920433-14-32((4chlorobenzyl)sulfanyl)5((pyrimidin2ylsulfanyl)methyl)(124)triazolo(15a)pyrimidin7(4H)one
2((4chlorobenzyl)thio)5((pyrimidin2ylthio)methyl)(124)triazolo(15a)pyrimidin7(4H)one
2((4chlorophenyl)methylsulfanyl)5(pyrimidin2ylsulfanylmethyl)1H(124)triazolo(15a)pyrimidin7one
2((4CHLOROPHENYL)METHYLTHIO)5(PYRIMIDIN2YLTHIOMETHYL)48DIHYDRO124TRIAZOLO(15A)PYRIMIDIN7ONE
920433143
C1=CN=C(N=C1)SCC2=CC(=O)N3C(=N2)N=C(N3)SCC4=CC=C(C=C4)Cl
Clc1ccc(cc1)CSc1nn2c(n1)(nH)c(cc2=O)CSc1ncccn1
InChI=1SC17H13ClN6OS2c18124211(3512)9261722152113(814(25)24(15)2317)102716196172016h18H910H2(H212223)
MFCD08719160
ZINC000100071782
ZINC100071782
ZINC9418912
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