Vitas-M small molecule compound
methyl 2-[({5-chloro-2-[(2-fluorobenzyl)sulfanyl]pyrimidin-4-yl}carbonyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Catalog ID
STK911799
SMILES COC(=O)c1c(NC(=O)c2nc(ncc2Cl)SCc2ccccc2F)sc2c1CCC2
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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 C21H17ClFN3O3S2 MW 477.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17ClFN3O3S2/c1-29-20(28)16-12-6-4-8-15(12)31-19(16)26-18(27)17-13(22)9-24-21(25-17)30-10-11-5-2-3-7-14(11)23/h2-3,5,7,9H,4,6,8,10H2,1H3,(H,26,27)InChIKey
MJJRABXYOSZQMV-UHFFFAOYSA-NSynonyms
COC(=O)C1=C(SC2=C1CCC2)NC(=O)C3=NC(=NC=C3Cl)SCC4=CC=CC=C4F
InChI=1SC21H17ClFN3O3S2c12920(28)161264815(12)3119(16)2618(27)1713(22)92421(2517)301011523714(11)23h23579H46810H21H3(H2627)
methyl2(((5chloro2((2fluorobenzyl)sulfanyl)pyrimidin4yl)carbonyl)amino)56dihydro4Hcyclopenta(b)thiophene3carboxylate
methyl2((5chloro2((2fluorophenyl)methylsulfanyl)pyrimidine4carbonyl)amino)56dihydro4Hcyclopenta(b)thiophene3carboxylate
MFCD07426738
ZINC000008916290
ZINC08916290
ZINC8916290
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