Vitas-M small molecule compound

N,N-dibenzyl-2-{3-[1,1-bis(4-methoxyphenyl)but-1-en-2-yl]-1H-indol-1-yl}ethanamine

Catalog ID
STL036451
SMILES COc1ccc(cc1)/C(=C(\c1cn(c2c1cccc2)CCN(Cc1ccccc1)Cc1ccccc1)/CC)/c1ccc(cc1)OC

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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 C42H42N2O2 MW 606.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C42H42N2O2/c1-4-38(42(34-19-23-36(45-2)24-20-34)35-21-25-37(46-3)26-22-35)40-31-44(41-18-12-11-17-39(40)41)28-27-43(29-32-13-7-5-8-14-32)30-33-15-9-6-10-16-33/h5-26,31H,4,27-30H2,1-3H3
InChIKey
NHHDUKVEPZZABU-UHFFFAOYSA-N
Synonyms

CCC(=C(C1=CC=C(C=C1)OC)C2=CC=C(C=C2)OC)C3=CN(C4=CC=CC=C43)CCN(CC5=CC=CC=C5)CC6=CC=CC=C6
COc1ccc(cc1)C(=C(c1cn(c2c1cccc2)CCN(Cc1ccccc1)Cc1ccccc1)CC)c1ccc(cc1)OC
InChI=1SC42H42N2O2c1438(42(34192336(452)242034)35212537(463)262235)403144(411812111739(40)41)282743(2932137581432)30331596101633h52631H42730H213H3
MFCD00846283
NNdibenzyl2(3(11bis(4methoxyphenyl)but1en2yl)1Hindol1yl)ethanamine
NNDIBENZYL2(3(11BIS(4METHOXYPHENYL)BUT1EN2YL)INDOL1YL)ETHANAMINE
ZINC000102815753
ZINC102815753

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Available files

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