Vitas-M small molecule compound
2-[(3-chlorobenzyl)sulfanyl]-N-(4-methoxyphenyl)-7-methyl[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
Catalog ID
STK789909
SMILES COc1ccc(cc1)NC(=O)c1cnc2n(c1C)nc(n2)SCc1cccc(c1)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 C21H18ClN5O2S MW 439.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18ClN5O2S/c1-13-18(19(28)24-16-6-8-17(29-2)9-7-16)11-23-20-25-21(26-27(13)20)30-12-14-4-3-5-15(22)10-14/h3-11H,12H2,1-2H3,(H,24,28)InChIKey
XVEYCXKUHGUACE-UHFFFAOYSA-NSynonyms
896668-57-82((3chlorobenzyl)sulfanyl)N(4methoxyphenyl)7methyl(124)triazolo(15a)pyrimidine6carboxamide
2((3chlorobenzyl)thio)N(4methoxyphenyl)7methyl(124)triazolo(15a)pyrimidine6carboxamide
2((3chlorophenyl)methylsulfanyl)N(4methoxyphenyl)7methyl(124)triazolo(15a)pyrimidine6carboxamide
896668578
CC1=C(C=NC2=NC(=NN12)SCC3=CC(=CC=C3)Cl)C(=O)NC4=CC=C(C=C4)OC
InChI=1SC21H18ClN5O2Sc11318(19(28)24166817(292)9716)1123202521(2627(13)20)30121443515(22)1014h311H12H212H3(H2428)
MFCD08088531
ZINC000009059479
ZINC09059479
ZINC9059479
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