Vitas-M small molecule compound
ethyl 2-({[5-chloro-2-(propylsulfanyl)pyrimidin-4-yl]carbonyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK881937
SMILES CCCSc1ncc(c(n1)C(=O)Nc1sc2c(c1C(=O)OCC)CCCC2)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 C19H22ClN3O3S2 MW 439.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H22ClN3O3S2/c1-3-9-27-19-21-10-12(20)15(22-19)16(24)23-17-14(18(25)26-4-2)11-7-5-6-8-13(11)28-17/h10H,3-9H2,1-2H3,(H,23,24)InChIKey
SOPHUWHYIXSERO-UHFFFAOYSA-NSynonyms
CCCSC1=NC=C(C(=N1)C(=O)NC2=C(C3=C(S2)CCCC3)C(=O)OCC)Cl
ethyl2(((5chloro2(propylsulfanyl)pyrimidin4yl)carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
ethyl2((5chloro2propylsulfanylpyrimidine4carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
InChI=1SC19H22ClN3O3S2c1392719211012(20)15(2219)16(24)231714(18(25)2642)11756813(11)2817h10H39H212H3(H2324)
MFCD06645871
ZINC000016742466
ZINC16742466
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