Vitas-M small molecule compound

2-([1]benzofuro[3,2-d]pyrimidin-4-ylsulfanyl)-1-(1-benzyl-5-methoxy-2-methyl-1H-indol-3-yl)ethanone

Catalog ID
STL001086
SMILES COc1ccc2c(c1)c(C(=O)CSc1ncnc3c1oc1c3cccc1)c(n2Cc1ccccc1)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 C29H23N3O3S MW 493.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H23N3O3S/c1-18-26(22-14-20(34-2)12-13-23(22)32(18)15-19-8-4-3-5-9-19)24(33)16-36-29-28-27(30-17-31-29)21-10-6-7-11-25(21)35-28/h3-14,17H,15-16H2,1-2H3
InChIKey
QCWDOELCTPUFCS-UHFFFAOYSA-N
Synonyms
848057-75-0
2((1)benzofuro(32d)pyrimidin4ylsulfanyl)1(1benzyl5methoxy2methyl1Hindol3yl)ethanone
2((1)BENZOFURO(32D)PYRIMIDIN4YLSULFANYL)1(1BENZYL5METHOXY2METHYLINDOL3YL)ETHANONE
2(benzofuro(32d)pyrimidin4ylthio)1(1benzyl5methoxy2methyl1Hindol3yl)ethanone
848057750
CC1=C(C2=C(N1CC3=CC=CC=C3)C=CC(=C2)OC)C(=O)CSC4=NC=NC5=C4OC6=CC=CC=C65
InChI=1SC29H23N3O3Sc11826(221420(342)121323(22)32(18)15198435919)24(33)1636292827(30173129)2110671125(21)3528h31417H1516H212H3
MFCD04186742
ZINC000002421227
ZINC02421227
ZINC2421227

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Available files

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