Vitas-M small molecule compound
ethyl 6-ethyl-2-{[({2-[3-(2-methylpropoxy)phenyl]quinolin-4-yl}carbonyl)carbamothioyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK301418
SMILES CCOC(=O)c1c(NC(=S)NC(=O)c2cc(nc3c2cccc3)c2cccc(c2)OCC(C)C)sc2c1CCC(C2)CC
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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 C34H37N3O4S2 MW 615.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H37N3O4S2/c1-5-21-14-15-25-29(16-21)43-32(30(25)33(39)40-6-2)37-34(42)36-31(38)26-18-28(35-27-13-8-7-12-24(26)27)22-10-9-11-23(17-22)41-19-20(3)4/h7-13,17-18,20-21H,5-6,14-16,19H2,1-4H3,(H2,36,37,38,42)InChIKey
YZFNHUBJHDEYED-UHFFFAOYSA-NSynonyms
438196-41-9438196419
CCC1CCC2=C(C1)SC(=C2C(=O)OCC)NC(=S)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC(=CC=C5)OCC(C)C
ethyl6ethyl2((((2(3(2methylpropoxy)phenyl)quinolin4yl)carbonyl)carbamothioyl)amino)4567tetrahydro1benzothiophene3carboxylate
ethyl6ethyl2((2(3(2methylpropoxy)phenyl)quinoline4carbonyl)carbamothioylamino)4567tetrahydro1benzothiophene3carboxylate
InChI=1SC34H37N3O4S2c152114152529(1621)4332(30(25)33(39)4062)3734(42)3631(38)261828(352713871224(26)27)221091123(1722)411920(3)4h71317182021H56141619H214H3(H236373842)
MFCD03073875
ZINC000008454350
ZINC000008454351
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