Vitas-M small molecule compound

3-(5,5-dimethyl-5,6-dihydro[1,2,4]triazolo[3,4-a]isoquinolin-3-yl)aniline

Catalog ID
STK830338
SMILES Nc1cccc(c1)c1nnc2n1C(C)(C)Cc1c2cccc1

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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 C18H18N4 MW 290.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18N4/c1-18(2)11-13-6-3-4-9-15(13)17-21-20-16(22(17)18)12-7-5-8-14(19)10-12/h3-10H,11,19H2,1-2H3
InChIKey
CZXIKEARXVNVMU-UHFFFAOYSA-N
Synonyms
302553-49-7
3(55dimethyl56dihydro(124)triazolo(34a)isoquinolin3yl)aniline
3(55DIMETHYL56DIHYDRO(124)TRIAZOLO(34A)ISOQUINOLIN3YL)PHENYLAMINE
3(55DIMETHYL6H(124)TRIAZOLO(34A)ISOQUINOLIN3YL)ANILINE
302553497
CC1(CC2=CC=CC=C2C3=NN=C(N31)C4=CC(=CC=C4)N)C
InChI=1SC18H18N4c118(2)1113634915(13)17212016(22(17)18)1275814(19)1012h310H1119H212H3
MFCD00608456
ZINC000000343634
ZINC00343634
ZINC343634

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Available files

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