Vitas-M small molecule compound

3-[(E)-{2-[4,6-di(pyrrolidin-1-yl)-1,3,5-triazin-2-yl]hydrazinylidene}methyl]-1-[2-(2-methylphenoxy)ethyl]-1H-indole

Catalog ID
STK017645
SMILES Cc1ccccc1OCCn1cc(c2c1cccc2)/C=N/Nc1nc(nc(n1)N1CCCC1)N1CCCC1

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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 C29H34N8O MW 510.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H34N8O/c1-22-10-2-5-13-26(22)38-19-18-37-21-23(24-11-3-4-12-25(24)37)20-30-34-27-31-28(35-14-6-7-15-35)33-29(32-27)36-16-8-9-17-36/h2-5,10-13,20-21H,6-9,14-19H2,1H3,(H,31,32,33,34)/b30-20+
InChIKey
PHVMTNUHMIWRON-TWKHWXDSSA-N
Synonyms

(E)3((2(46di(pyrrolidin1yl)135triazin2yl)hydrazono)methyl)1(2(otolyloxy)ethyl)1Hindole
1(2(2METHYLPHENOXY)ETHYL)1HINDOLE3CARBALDEHYDE(46DIPYRROLIDIN1YL135TRIAZIN2YL)HYDRAZONE
3((E)(2(46DI(PYRROLIDIN1YL)135TRIAZIN2YL)HYDRAZINYLIDENE)METHYL)1(2(2METHYLPHENOXY)ETHYL)1HINDOLE
CC1=CC=CC=C1OCCN2C=C(C3=CC=CC=C32)C=NNC4=NC(=NC(=N4)N5CCCC5)N6CCCC6
Cc1ccccc1OCCn1cc(c2c1cccc2)C=NNc1nc(nc(n1)N1CCCC1)N1CCCC1
InChI=1SC29H34N8Oc12210251326(22)381918372123(2411341225(24)37)203034273128(3514671535)3329(3227)3616891736h2510132021H691419H21H3(H31323334)b3020+
MFCD02950920
N((E)(1(2(2methylphenoxy)ethyl)indol3yl)methylideneamino)46dipyrrolidin1yl135triazin2amine
STK017645
ZINC000008451364
ZINC101399316

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Available files

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