Vitas-M small molecule compound

5-chloro-2-[(2-fluorobenzyl)sulfanyl]-N-(6-methyl-1,3-benzothiazol-2-yl)pyrimidine-4-carboxamide

Catalog ID
STK911778
SMILES Cc1ccc2c(c1)sc(n2)NC(=O)c1nc(ncc1Cl)SCc1ccccc1F

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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 C20H14ClFN4OS2 MW 444.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H14ClFN4OS2/c1-11-6-7-15-16(8-11)29-20(24-15)26-18(27)17-13(21)9-23-19(25-17)28-10-12-4-2-3-5-14(12)22/h2-9H,10H2,1H3,(H,24,26,27)
InChIKey
IKOQYXMSRXEXGH-UHFFFAOYSA-N
Synonyms

5chloro2((2fluorobenzyl)sulfanyl)N(6methyl13benzothiazol2yl)pyrimidine4carboxamide
5chloro2((2fluorophenyl)methylsulfanyl)N(6methyl13benzothiazol2yl)pyrimidine4carboxamide
CC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=NC(=NC=C3Cl)SCC4=CC=CC=C4F
InChI=1SC20H14ClFN4OS2c111671516(811)2920(2415)2618(27)1713(21)92319(2517)281012423514(12)22h29H10H21H3(H242627)
MFCD07426716
ZINC000008613769
ZINC08613769
ZINC8613769

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.