Vitas-M small molecule compound

1-benzyl-3-(4H-1,2,4-triazol-4-yl)thiourea

Catalog ID
STK389172
SMILES S=C(Nn1cnnc1)NCc1ccccc1

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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 C10H11N5S MW 233.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C10H11N5S/c16-10(14-15-7-12-13-8-15)11-6-9-4-2-1-3-5-9/h1-5,7-8H,6H2,(H2,11,14,16)
InChIKey
KWPLMNOIDRPRKB-UHFFFAOYSA-N
Synonyms
454459-10-0
(BENZYLAMINO)(124TRIAZOL4YLAMINO)METHANE1THIONE
1BENZYL3(124TRIAZOL4YL)THIOUREA
1benzyl3(4H124triazol4yl)thiourea
454459100
C1=CC=C(C=C1)CNC(=S)NN2C=NN=C2
InChI=1SC10H11N5Sc1610(141571213815)1169421359h1578H6H2(H2111416)
MFCD03487953
ZINC000004507799
ZINC04507799
ZINC4507799

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Available files

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