Vitas-M small molecule compound

N-benzyl-2-{1-[2-(4-methylphenyl)-1H-indol-3-yl]-3-oxo-1,3-dihydro-2H-isoindol-2-yl}propanamide

Catalog ID
STK277295
SMILES Cc1ccc(cc1)c1[nH]c2c(c1C1N(C(C(=O)NCc3ccccc3)C)C(=O)c3c1cccc3)cccc2

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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 C33H29N3O2 MW 499.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H29N3O2/c1-21-16-18-24(19-17-21)30-29(27-14-8-9-15-28(27)35-30)31-25-12-6-7-13-26(25)33(38)36(31)22(2)32(37)34-20-23-10-4-3-5-11-23/h3-19,22,31,35H,20H2,1-2H3,(H,34,37)
InChIKey
NVPDDGFWKUHQDQ-UHFFFAOYSA-N
Synonyms

CC1=CC=C(C=C1)C2=C(C3=CC=CC=C3N2)C4C5=CC=CC=C5C(=O)N4C(C)C(=O)NCC6=CC=CC=C6
Cc1ccc(cc1)c1(nH)c2c(c1C1N(C(C(=O)NCc3ccccc3)C)C(=O)c3c1cccc3)cccc2
InChI=1SC33H29N3O2c121161824(191721)3029(2714891528(27)3530)312512671326(25)33(38)36(31)22(2)32(37)342023104351123h319223135H20H212H3(H3437)
MFCD09268897
Nbenzyl2(1(2(4methylphenyl)1Hindol3yl)3oxo13dihydro2Hisoindol2yl)propanamide
Nbenzyl2(1(2(4methylphenyl)1Hindol3yl)3oxo1Hisoindol2yl)propanamide
ZINC000009095140
ZINC000009095143

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Available files

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