Vitas-M small molecule compound
ethyl 8,8-dimethyl-1-{[(phenylcarbonyl)carbamothioyl]amino}-5-(propan-2-yl)-8,9-dihydro-6H-pyrano[4,3-d]thieno[2,3-b]pyridine-2-carboxylate
Catalog ID
STK721666
SMILES CCOC(=O)c1sc2c(c1NC(=S)NC(=O)c1ccccc1)c1CC(C)(C)OCc1c(n2)C(C)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 C26H29N3O4S2 MW 511.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H29N3O4S2/c1-6-32-24(31)21-20(28-25(34)29-22(30)15-10-8-7-9-11-15)18-16-12-26(4,5)33-13-17(16)19(14(2)3)27-23(18)35-21/h7-11,14H,6,12-13H2,1-5H3,(H2,28,29,30,34)InChIKey
QJSSMLDQAJPBFY-UHFFFAOYSA-NSynonyms
843638-23-3843638233
CCOC(=O)C1=C(C2=C3CC(OCC3=C(N=C2S1)C(C)C)(C)C)NC(=S)NC(=O)C4=CC=CC=C4
ethyl1(3benzoylthioureido)5isopropyl88dimethyl89dihydro6Hpyrano(43d)thieno(23b)pyridine2carboxylate
ethyl88dimethyl1(((phenylcarbonyl)carbamothioyl)amino)5(propan2yl)89dihydro6Hpyrano(43d)thieno(23b)pyridine2carboxylate
InChI=1SC26H29N3O4S2c163224(31)2120(2825(34)2922(30)15108791115)18161226(45)331317(16)19(14(2)3)2723(18)3521h71114H61213H215H3(H228293034)
MFCD04016332
ZINC000009459240
ZINC09459240
ZINC9459240
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