Vitas-M small molecule compound

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

Catalog ID
STL437698
SMILES S=C(c1nnn(c1)Cc1ccccc1)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 C14H16N4S MW 272.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H16N4S/c19-14(17-8-4-5-9-17)13-11-18(16-15-13)10-12-6-2-1-3-7-12/h1-3,6-7,11H,4-5,8-10H2
InChIKey
HWTTXNXURYIMEX-UHFFFAOYSA-N
Synonyms

(1BENZYL1H(123)TRIAZOL4YL)PYRROLIDIN1YLMETHANETHIONE
(1benzyl1H123triazol4yl)(pyrrolidin1yl)methanethione
(1BENZYLTRIAZOL4YL)PYRROLIDIN1YLMETHANETHIONE
1BENZYL4(PYRROLIDIN1YLCARBONOTHIOYL)1H123TRIAZOLE
C1CCN(C1)C(=S)C2=CN(N=N2)CC3=CC=CC=C3
InChI=1SC14H16N4Sc1914(17845917)131118(161513)10126213712h136711H45810H2
MFCD06242916
ZINC000001417916
ZINC01417916
ZINC1417916

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Available files

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