Vitas-M small molecule compound

1-(4-methoxyphenyl)-3-(1,3,5-triazatricyclo[3.3.1.1~3,7~]dec-7-yl)thiourea

Catalog ID
STK092611
SMILES COc1ccc(cc1)NC(=S)NC12CN3CN(C2)CN(C1)C3

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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 C15H21N5OS MW 319.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H21N5OS/c1-21-13-4-2-12(3-5-13)16-14(22)17-15-6-18-9-19(7-15)11-20(8-15)10-18/h2-5H,6-11H2,1H3,(H2,16,17,22)
InChIKey
VQVCRQJRSXIJRU-UHFFFAOYSA-N
Synonyms

1(4methoxyphenyl)3(135triazatricyclo(3311~37~)dec7yl)thiourea
COC1=CC=C(C=C1)NC(=S)NC23CN4CN(C2)CN(C3)C4
COc1ccc(cc1)NC(=S)NC12CN3CN(C2)CN(C1)C3
InChI=1SC15H21N5OSc121134212(3513)1614(22)1715618919(715)1120(815)1018h25H611H21H3(H2161722)
MFCD02922582
STK092611
ZINC000019318902
ZINC19318902

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Available files

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