Vitas-M small molecule compound

ethyl 6-bromo-5-methoxy-1-phenyl-2-[(phenylsulfanyl)methyl]-1H-indole-3-carboxylate

Catalog ID
STK759202
SMILES CCOC(=O)c1c2cc(OC)c(cc2n(c1CSc1ccccc1)c1ccccc1)Br

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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 C25H22BrNO3S MW 496.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22BrNO3S/c1-3-30-25(28)24-19-14-23(29-2)20(26)15-21(19)27(17-10-6-4-7-11-17)22(24)16-31-18-12-8-5-9-13-18/h4-15H,3,16H2,1-2H3
InChIKey
BASZIBZKBABMLZ-UHFFFAOYSA-N
Synonyms
337311-95-2
337311952
CCOC(=O)C1=C(N(C2=CC(=C(C=C21)OC)Br)C3=CC=CC=C3)CSC4=CC=CC=C4
ethyl6bromo5methoxy1phenyl2((phenylsulfanyl)methyl)1Hindole3carboxylate
ethyl6bromo5methoxy1phenyl2((phenylthio)methyl)1Hindole3carboxylate
ETHYL6BROMO5METHOXY1PHENYL2(PHENYLSULFANYLMETHYL)INDOLE3CARBOXYLATE
InChI=1SC25H22BrNO3Sc133025(28)24191423(292)20(26)1521(19)27(17106471117)22(24)163118128591318h415H316H212H3
MFCD00329499
ZINC000002354871
ZINC02354871
ZINC2354871

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Available files

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