Vitas-M small molecule compound
N-(1,3-benzodioxol-5-ylmethyl)-5-chloro-2-[(2-fluorobenzyl)sulfanyl]pyrimidine-4-carboxamide
Catalog ID
STK912950
SMILES O=C(c1nc(ncc1Cl)SCc1ccccc1F)NCc1ccc2c(c1)OCO2
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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 C20H15ClFN3O3S MW 431.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H15ClFN3O3S/c21-14-9-24-20(29-10-13-3-1-2-4-15(13)22)25-18(14)19(26)23-8-12-5-6-16-17(7-12)28-11-27-16/h1-7,9H,8,10-11H2,(H,23,26)InChIKey
YWSXMBDFJMARQU-UHFFFAOYSA-NSynonyms
874207-06-4874207064
C1OC2=C(O1)C=C(C=C2)CNC(=O)C3=NC(=NC=C3Cl)SCC4=CC=CC=C4F
InChI=1SC20H15ClFN3O3Sc211492420(291013312415(13)22)2518(14)19(26)23812561617(712)28112716h179H81011H2(H2326)
MFCD07427913
N(13benzodioxol5ylmethyl)5chloro2((2fluorobenzyl)sulfanyl)pyrimidine4carboxamide
N(13benzodioxol5ylmethyl)5chloro2((2fluorophenyl)methylsulfanyl)pyrimidine4carboxamide
ZINC000008917389
ZINC08917389
ZINC8917389
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