Vitas-M small molecule compound
methyl 2-({[2-(benzylsulfanyl)-5-chloropyrimidin-4-yl]carbonyl}amino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Catalog ID
STK909217
SMILES COC(=O)c1c(NC(=O)c2nc(SCc3ccccc3)ncc2Cl)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 C21H18ClN3O3S2 MW 459.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18ClN3O3S2/c1-28-20(27)16-13-8-5-9-15(13)30-19(16)25-18(26)17-14(22)10-23-21(24-17)29-11-12-6-3-2-4-7-12/h2-4,6-7,10H,5,8-9,11H2,1H3,(H,25,26)InChIKey
DUHSZXWHRFFOCJ-UHFFFAOYSA-NSynonyms
COC(=O)C1=C(SC2=C1CCC2)NC(=O)C3=NC(=NC=C3Cl)SCC4=CC=CC=C4
InChI=1SC21H18ClN3O3S2c12820(27)161385915(13)3019(16)2518(26)1714(22)102321(2417)2911126324712h246710H58911H21H3(H2526)
methyl2(((2(benzylsulfanyl)5chloropyrimidin4yl)carbonyl)amino)56dihydro4Hcyclopenta(b)thiophene3carboxylate
METHYL2((2BENZYLSULFANYL5CHLOROPYRIMIDINE4CARBONYL)AMINO)56DIHYDRO4HCYCLOPENTA(B)THIOPHENE3CARBOXYLATE
MFCD06629124
ZINC000016447864
ZINC16447864
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