Vitas-M small molecule compound
ethyl 6-(2-methylbutan-2-yl)-2-({[2-(4-propylphenyl)quinolin-4-yl]carbonyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK422510
SMILES CCOC(=O)c1c(sc2c1CCC(C2)C(CC)(C)C)NC(=O)c1cc(nc2c1cccc2)c1ccc(cc1)CCC
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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/c1-6-11-22-14-16-23(17-15-22)29-21-27(25-12-9-10-13-28(25)36-29)32(38)37-33-31(34(39)40-8-3)26-19-18-24(20-30(26)41-33)35(4,5)7-2/h9-10,12-17,21,24H,6-8,11,18-20H2,1-5H3,(H,37,38)InChIKey
BZCAEIRYMBNHRY-UHFFFAOYSA-NSynonyms
CCCC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=C(C5=C(S4)CC(CC5)C(C)(C)CC)C(=O)OCC
ethyl6(2methylbutan2yl)2(((2(4propylphenyl)quinolin4yl)carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
ethyl6(2methylbutan2yl)2((2(4propylphenyl)quinoline4carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
InChI=1SC35H40N2O3Sc161122141623(171522)292127(25129101328(25)3629)32(38)373331(34(39)4083)26191824(2030(26)4133)35(45)72h91012172124H68111820H215H3(H3738)
MFCD02373675
ZINC000002770441
ZINC000002770442
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