Vitas-M small molecule compound
3-[({5-chloro-2-[(4-fluorobenzyl)sulfanyl]pyrimidin-4-yl}carbonyl)amino]benzoic acid
Catalog ID
STL214539
SMILES Fc1ccc(cc1)CSc1ncc(c(n1)C(=O)Nc1cccc(c1)C(=O)O)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 C19H13ClFN3O3S MW 417.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H13ClFN3O3S/c20-15-9-22-19(28-10-11-4-6-13(21)7-5-11)24-16(15)17(25)23-14-3-1-2-12(8-14)18(26)27/h1-9H,10H2,(H,23,25)(H,26,27)InChIKey
MTNUOJUFNHGSBP-UHFFFAOYSA-NSynonyms
3(((5chloro2((4fluorobenzyl)sulfanyl)pyrimidin4yl)carbonyl)amino)benzoicacid
3((5chloro2((4fluorophenyl)methylsulfanyl)pyrimidine4carbonyl)amino)benzoicacid
C1=CC(=CC(=C1)NC(=O)C2=NC(=NC=C2Cl)SCC3=CC=C(C=C3)F)C(=O)O
InChI=1SC19H13ClFN3O3Sc201592219(2810114613(21)7511)2416(15)17(25)231431212(814)18(26)27h19H10H2(H2325)(H2627)
MFCD18078344
ZINC000032593764
ZINC32593764
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