Vitas-M small molecule compound
ethyl 5-phenyl-1-{[(phenylcarbonyl)carbamothioyl]amino}-7,8-dihydro-6H-cyclopenta[d]thieno[2,3-b]pyridine-2-carboxylate
Catalog ID
STK551405
SMILES CCOC(=O)c1sc2c(c1NC(=S)NC(=O)c1ccccc1)c1CCCc1c(n2)c1ccccc1
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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 C27H23N3O3S2 MW 501.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H23N3O3S2/c1-2-33-26(32)23-22(29-27(34)30-24(31)17-12-7-4-8-13-17)20-18-14-9-15-19(18)21(28-25(20)35-23)16-10-5-3-6-11-16/h3-8,10-13H,2,9,14-15H2,1H3,(H2,29,30,31,34)InChIKey
GASBMKXXWLXIFA-UHFFFAOYSA-NSynonyms
840457-84-3840457843
CCOC(=O)C1=C(C2=C3CCCC3=C(N=C2S1)C4=CC=CC=C4)NC(=S)NC(=O)C5=CC=CC=C5
ethyl1(3benzoylthioureido)5phenyl78dihydro6Hcyclopenta(d)thieno(23b)pyridine2carboxylate
ethyl5phenyl1(((phenylcarbonyl)carbamothioyl)amino)78dihydro6Hcyclopenta(d)thieno(23b)pyridine2carboxylate
InChI=1SC27H23N3O3S2c123326(32)2322(2927(34)3024(31)17127481317)20181491519(18)21(2825(20)3523)16105361116h381013H291415H21H3(H229303134)
MFCD03694493
ZINC000009543296
ZINC09543296
ZINC9543296
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