Vitas-M small molecule compound
ethyl 2-[({5-chloro-2-[(2-methylbenzyl)sulfanyl]pyrimidin-4-yl}carbonyl)amino]-4,5-dimethylthiophene-3-carboxylate
Catalog ID
STK913066
SMILES CCOC(=O)c1c(NC(=O)c2nc(ncc2Cl)SCc2ccccc2C)sc(c1C)C
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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 C22H22ClN3O3S2 MW 476.02 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22ClN3O3S2/c1-5-29-21(28)17-13(3)14(4)31-20(17)26-19(27)18-16(23)10-24-22(25-18)30-11-15-9-7-6-8-12(15)2/h6-10H,5,11H2,1-4H3,(H,26,27)InChIKey
SCGPKAZCKWHALV-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC(=C1C)C)NC(=O)C2=NC(=NC=C2Cl)SCC3=CC=CC=C3C
ethyl2(((5chloro2((2methylbenzyl)sulfanyl)pyrimidin4yl)carbonyl)amino)45dimethylthiophene3carboxylate
ethyl2((5chloro2((2methylphenyl)methylsulfanyl)pyrimidine4carbonyl)amino)45dimethylthiophene3carboxylate
InChI=1SC22H22ClN3O3S2c152921(28)1713(3)14(4)3120(17)2619(27)1816(23)102422(2518)301115976812(15)2h610H511H214H3(H2627)
MFCD07428032
ZINC000008917479
ZINC08917479
ZINC8917479
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