Vitas-M small molecule compound

4-[(2,5-dimethylbenzyl)sulfanyl]-1-phenyl-1H-pyrazolo[3,4-d]pyrimidine

Catalog ID
STL347752
SMILES Cc1ccc(c(c1)CSc1ncnc2c1cnn2c1ccccc1)C

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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 C20H18N4S MW 346.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18N4S/c1-14-8-9-15(2)16(10-14)12-25-20-18-11-23-24(19(18)21-13-22-20)17-6-4-3-5-7-17/h3-11,13H,12H2,1-2H3
InChIKey
KLJRQAIRNNFHSO-UHFFFAOYSA-N
Synonyms
578720-81-7
4((25dimethylbenzyl)sulfanyl)1phenyl1Hpyrazolo(34d)pyrimidine
4((25dimethylbenzyl)thio)1phenyl1Hpyrazolo(34d)pyrimidine
4((25DIMETHYLPHENYL)METHYLSULFANYL)1PHENYLPYRAZOLO(34D)PYRIMIDINE
578720817
CC1=CC(=C(C=C1)C)CSC2=NC=NC3=C2C=NN3C4=CC=CC=C4
InChI=1SC20H18N4Sc1148915(2)16(1014)12252018112324(19(18)21132220)176435717h31113H12H212H3
MFCD04029656
ZINC000005478211
ZINC05478211
ZINC5478211

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Available files

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