Vitas-M small molecule compound
ethyl 2-({[2-(3-ethoxyphenyl)quinolin-4-yl]carbonyl}amino)-5-methyl-4-[4-(2-methylpropyl)phenyl]thiophene-3-carboxylate
Catalog ID
STK423729
SMILES CCOC(=O)c1c(NC(=O)c2cc(nc3c2cccc3)c2cccc(c2)OCC)sc(c1c1ccc(cc1)CC(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 C36H36N2O4S MW 592.76 g/mol Purity >90% as per NMR
InChI
InChI=1S/C36H36N2O4S/c1-6-41-27-12-10-11-26(20-27)31-21-29(28-13-8-9-14-30(28)37-31)34(39)38-35-33(36(40)42-7-2)32(23(5)43-35)25-17-15-24(16-18-25)19-22(3)4/h8-18,20-22H,6-7,19H2,1-5H3,(H,38,39)InChIKey
BMCOFZDBEHESTH-UHFFFAOYSA-NSynonyms
CCOC1=CC=CC(=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=C(C(=C(S4)C)C5=CC=C(C=C5)CC(C)C)C(=O)OCC
ethyl2(((2(3ethoxyphenyl)quinolin4yl)carbonyl)amino)5methyl4(4(2methylpropyl)phenyl)thiophene3carboxylate
ETHYL2((2(3ETHOXYPHENYL)(4QUINOLYL))CARBONYLAMINO)5METHYL4(4(2METHYLPROPYL)PHENYL)THIOPHENE3CARBOXYLATE
ethyl2((2(3ethoxyphenyl)quinoline4carbonyl)amino)5methyl4(4(2methylpropyl)phenyl)thiophene3carboxylate
InChI=1SC36H36N2O4Sc16412712101126(2027)312129(2813891430(28)3731)34(39)383533(36(40)4272)32(23(5)4335)25171524(161825)1922(3)4h8182022H6719H215H3(H3839)
MFCD02176801
ZINC000002759628
ZINC2759628
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