Vitas-M small molecule compound

ethyl 5-(acetyloxy)-2-[(diethylamino)methyl]-1-methyl-6,8-diphenyl-1,6-dihydropyrrolo[2,3-e]indazole-3-carboxylate

Catalog ID
STK532978
SMILES CCOC(=O)c1c2cc(OC(=O)C)c3c(c2n(c1CN(CC)CC)C)c(nn3c1ccccc1)c1ccccc1

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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 C32H34N4O4 MW 538.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H34N4O4/c1-6-35(7-2)20-25-27(32(38)39-8-3)24-19-26(40-21(4)37)31-28(30(24)34(25)5)29(22-15-11-9-12-16-22)33-36(31)23-17-13-10-14-18-23/h9-19H,6-8,20H2,1-5H3
InChIKey
VPBXYQSKMUDHRC-UHFFFAOYSA-N
Synonyms
374550-31-9
374550319
CCN(CC)CC1=C(C2=CC(=C3C(=C2N1C)C(=NN3C4=CC=CC=C4)C5=CC=CC=C5)OC(=O)C)C(=O)OCC
ethyl5(acetyloxy)2((diethylamino)methyl)1methyl68diphenyl16dihydropyrrolo(23e)indazole3carboxylate
ethyl5acetoxy2((diethylamino)methyl)1methyl68diphenyl16dihydropyrrolo(23e)indazole3carboxylate
ETHYL5ACETYLOXY2(DIETHYLAMINOMETHYL)1METHYL68DIPHENYLPYRROLO(23E)INDAZOLE3CARBOXYLATE
InChI=1SC32H34N4O4c1635(72)202527(32(38)3983)241926(4021(4)37)3128(30(24)34(25)5)29(2215119121622)3336(31)23171310141823h919H6820H215H3
MFCD01957384
ZINC000033353759
ZINC33353759

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Available files

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