Vitas-M small molecule compound
(2E)-3-[1-(2-hydroxy-3-{[2-(1H-indol-3-yl)ethyl]amino}propyl)-1H-indol-3-yl]-1-(4-methoxyphenyl)prop-2-en-1-one
Catalog ID
STL441145
SMILES COc1ccc(cc1)C(=O)/C=C/c1cn(c2c1cccc2)CC(CNCCc1c[nH]c2c1cccc2)O
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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 C31H31N3O3 MW 493.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H31N3O3/c1-37-26-13-10-22(11-14-26)31(36)15-12-24-20-34(30-9-5-3-7-28(24)30)21-25(35)19-32-17-16-23-18-33-29-8-4-2-6-27(23)29/h2-15,18,20,25,32-33,35H,16-17,19,21H2,1H3/b15-12+InChIKey
QNSOXICMTHZKLD-NTCAYCPXSA-NSynonyms
(2E)3(1(2hydroxy3((2(1Hindol3yl)ethyl)amino)propyl)1Hindol3yl)1(4methoxyphenyl)prop2en1one
(E)3(1(2HYDROXY3(2(1HINDOL3YL)ETHYLAMINO)PROPYL)INDOL3YL)1(4METHOXYPHENYL)PROP2EN1ONE
COC1=CC=C(C=C1)C(=O)C=CC2=CN(C3=CC=CC=C32)CC(CNCCC4=CNC5=CC=CC=C54)O
COc1ccc(cc1)C(=O)C=Cc1cn(c2c1cccc2)CC(CNCCc1c(nH)c2c1cccc2)O
InChI=1SC31H31N3O3c13726131022(111426)31(36)1512242034(30953728(24)30)2125(35)1932171623183329842627(23)29h215182025323335H16171921H21H3b1512+
MFCD07756667
ZINC000008770122
ZINC000008770126
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