Vitas-M small molecule compound

4-[(1H-benzimidazol-2-ylmethyl)sulfanyl]-1-benzyl-1H-pyrazolo[3,4-d]pyrimidine

Catalog ID
STL346907
SMILES c1ccc(cc1)Cn1ncc2c1ncnc2SCc1nc2c([nH]1)cccc2

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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 C20H16N6S MW 372.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16N6S/c1-2-6-14(7-3-1)11-26-19-15(10-23-26)20(22-13-21-19)27-12-18-24-16-8-4-5-9-17(16)25-18/h1-10,13H,11-12H2,(H,24,25)
InChIKey
PJYOJYHBKFKUFA-UHFFFAOYSA-N
Synonyms
848999-87-1
4(((1Hbenzo(d)imidazol2yl)methyl)thio)1benzyl1Hpyrazolo(34d)pyrimidine
4((1Hbenzimidazol2ylmethyl)sulfanyl)1benzyl1Hpyrazolo(34d)pyrimidine
4(1HBENZIMIDAZOL2YLMETHYLSULFANYL)1BENZYLPYRAZOLO(34D)PYRIMIDINE
848999871
C1=CC=C(C=C1)CN2C3=C(C=N2)C(=NC=N3)SCC4=NC5=CC=CC=C5N4
c1ccc(cc1)Cn1ncc2c1ncnc2SCc1nc2c((nH)1)cccc2
InChI=1SC20H16N6Sc12614(731)11261915(102326)20(22132119)2712182416845917(16)2518h11013H1112H2(H2425)
MFCD04009520
ZINC000008310443
ZINC08310443
ZINC8310443

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Available files

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