Vitas-M small molecule compound
ethyl 2-[({5-chloro-2-[(4-fluorobenzyl)sulfanyl]pyrimidin-4-yl}carbonyl)amino]-4-phenylthiophene-3-carboxylate
Catalog ID
STK909947
SMILES CCOC(=O)c1c(scc1c1ccccc1)NC(=O)c1nc(ncc1Cl)SCc1ccc(cc1)F
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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 C25H19ClFN3O3S2 MW 528.03 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H19ClFN3O3S2/c1-2-33-24(32)20-18(16-6-4-3-5-7-16)14-34-23(20)30-22(31)21-19(26)12-28-25(29-21)35-13-15-8-10-17(27)11-9-15/h3-12,14H,2,13H2,1H3,(H,30,31)InChIKey
KHVBGBRPEPQYCS-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)C3=NC(=NC=C3Cl)SCC4=CC=C(C=C4)F
ethyl2(((5chloro2((4fluorobenzyl)sulfanyl)pyrimidin4yl)carbonyl)amino)4phenylthiophene3carboxylate
ethyl2((5chloro2((4fluorophenyl)methylsulfanyl)pyrimidine4carbonyl)amino)4phenylthiophene3carboxylate
InChI=1SC25H19ClFN3O3S2c123324(32)2018(166435716)143423(20)3022(31)2119(26)122825(2921)35131581017(27)11915h31214H213H21H3(H3031)
MFCD06649071
ZINC000098047884
ZINC98047884
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