Vitas-M small molecule compound

ethyl 5-{[(4-methylphenyl)sulfonyl]oxy}-2-(morpholin-4-ylmethyl)-1-phenyl-1H-indole-3-carboxylate

Catalog ID
STK526431
SMILES CCOC(=O)c1c2cc(ccc2n(c1CN1CCOCC1)c1ccccc1)OS(=O)(=O)c1ccc(cc1)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 C29H30N2O6S MW 534.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H30N2O6S/c1-3-36-29(32)28-25-19-23(37-38(33,34)24-12-9-21(2)10-13-24)11-14-26(25)31(22-7-5-4-6-8-22)27(28)20-30-15-17-35-18-16-30/h4-14,19H,3,15-18,20H2,1-2H3
InChIKey
VWOGVFJRNOCICE-UHFFFAOYSA-N
Synonyms
369605-31-2
369605312
CCOC(=O)C1=C(N(C2=C1C=C(C=C2)OS(=O)(=O)C3=CC=C(C=C3)C)C4=CC=CC=C4)CN5CCOCC5
ethyl2(morpholinomethyl)1phenyl5(tosyloxy)1Hindole3carboxylate
ETHYL5(((4METHYLPHENYL)SULFONYL)OXY)2(4MORPHOLINYLMETHYL)1PHENYL1HINDOLE3CARBOXYLATE
ethyl5(((4methylphenyl)sulfonyl)oxy)2(morpholin4ylmethyl)1phenyl1Hindole3carboxylate
ETHYL5(4METHYLPHENYL)SULFONYLOXY2(MORPHOLIN4YLMETHYL)1PHENYLINDOLE3CARBOXYLATE
InChI=1SC29H30N2O6Sc133629(32)28251923(3738(3334)2412921(2)101324)111426(25)31(227546822)27(28)2030151735181630h41419H3151820H212H3
MFCD00552033
ZINC000095763199
ZINC95763199

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.