Vitas-M small molecule compound
ethyl 6-tert-butyl-2-({[2-(4-tert-butylphenyl)quinolin-4-yl]carbonyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK424082
SMILES CCOC(=O)c1c(sc2c1CCC(C2)C(C)(C)C)NC(=O)c1cc(nc2c1cccc2)c1ccc(cc1)C(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 C35H40N2O3S MW 568.78 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H40N2O3S/c1-8-40-33(39)30-25-18-17-23(35(5,6)7)19-29(25)41-32(30)37-31(38)26-20-28(36-27-12-10-9-11-24(26)27)21-13-15-22(16-14-21)34(2,3)4/h9-16,20,23H,8,17-19H2,1-7H3,(H,37,38)InChIKey
PWVGBBYEEPOAQI-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC2=C1CCC(C2)C(C)(C)C)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=C(C=C5)C(C)(C)C
ethyl6tertbutyl2(((2(4tertbutylphenyl)quinolin4yl)carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
ethyl6tertbutyl2((2(4tertbutylphenyl)quinoline4carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
InChI=1SC35H40N2O3Sc184033(39)3025181723(35(56)7)1929(25)4132(30)3731(38)262028(3627121091124(26)27)21131522(161421)34(23)4h9162023H81719H217H3(H3738)
MFCD02176410
ZINC000002759172
ZINC000002759173
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