Vitas-M small molecule compound
6-benzyl-2-[(2-chlorobenzyl)sulfanyl]-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Catalog ID
STK250954
SMILES Clc1ccccc1CSc1nn2c(n1)[nH]c(c(c2=O)Cc1ccccc1)C
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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 C20H17ClN4OS MW 396.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17ClN4OS/c1-13-16(11-14-7-3-2-4-8-14)18(26)25-19(22-13)23-20(24-25)27-12-15-9-5-6-10-17(15)21/h2-10H,11-12H2,1H3,(H,22,23,24)InChIKey
BXDCJSWELVHYON-UHFFFAOYSA-NSynonyms
898915-52-12((2CHLOROPHENYL)METHYLTHIO)5METHYL6BENZYL48DIHYDRO124TRIAZOLO(15A)PYRIMIDIN7ONE
6benzyl2((2chlorobenzyl)sulfanyl)5methyl(124)triazolo(15a)pyrimidin7(4H)one
6benzyl2((2chlorobenzyl)thio)5methyl(124)triazolo(15a)pyrimidin7(4H)one
6benzyl2((2chlorophenyl)methylsulfanyl)5methyl1H(124)triazolo(15a)pyrimidin7one
898915521
CC1=C(C(=O)N2C(=N1)N=C(N2)SCC3=CC=CC=C3Cl)CC4=CC=CC=C4
Clc1ccccc1CSc1nn2c(n1)(nH)c(c(c2=O)Cc1ccccc1)C
InChI=1SC20H17ClN4OSc11316(11147324814)18(26)2519(2213)2320(2425)2712159561017(15)21h210H1112H21H3(H222324)
MFCD07638653
ZINC000100133754
ZINC100133754
ZINC18029808
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