Vitas-M small molecule compound

6-benzyl-3-{[2-(5-methyl-1H-indol-3-yl)ethyl]amino}-1,2,4-triazin-5(4H)-one

Catalog ID
STK965107
SMILES Cc1ccc2c(c1)c(CCNc1nnc(c(=O)[nH]1)Cc1ccccc1)c[nH]2

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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 C21H21N5O MW 359.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N5O/c1-14-7-8-18-17(11-14)16(13-23-18)9-10-22-21-24-20(27)19(25-26-21)12-15-5-3-2-4-6-15/h2-8,11,13,23H,9-10,12H2,1H3,(H2,22,24,26,27)
InChIKey
WDVJBUMOSYTNMY-UHFFFAOYSA-N
Synonyms

6benzyl3((2(5methyl1Hindol3yl)ethyl)amino)124triazin5(4H)one
6BENZYL3(2(5METHYL1HINDOL3YL)ETHYLAMINO)2H124TRIAZIN5ONE
CC1=CC2=C(C=C1)NC=C2CCNC3=NC(=O)C(=NN3)CC4=CC=CC=C4
Cc1ccc2c(c1)c(CCNc1nnc(c(=O)(nH)1)Cc1ccccc1)c(nH)2
InChI=1SC21H21N5Oc114781817(1114)16(132318)91022212420(27)19(252621)12155324615h28111323H91012H21H3(H222242627)
MFCD07756572
ZINC000004818454
ZINC04818454
ZINC4818454

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Available files

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