Vitas-M small molecule compound

8-(3-chlorophenyl)-6-(propylsulfanyl)-2,3,4,8-tetrahydropyrazolo[4,3-e]pyrimido[1,2-c]pyrimidine

Catalog ID
STK638792
SMILES CCCSc1nc2n(ncc2c2=NCCCn12)c1cccc(c1)Cl

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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 C17H18ClN5S MW 359.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18ClN5S/c1-2-9-24-17-21-16-14(15-19-7-4-8-22(15)17)11-20-23(16)13-6-3-5-12(18)10-13/h3,5-6,10-11H,2,4,7-9H2,1H3
InChIKey
ZEDXQPMUOKEOOJ-UHFFFAOYSA-N
Synonyms
1010922-40-3
1010922403
8(3chlorophenyl)6(propylsulfanyl)2348tetrahydropyrazolo(43e)pyrimido(12c)pyrimidine
8(3chlorophenyl)6(propylthio)2348tetrahydropyrazolo(43e)pyrimido(12c)pyrimidine
CCCSC1=NC2=C(C=NN2C3=CC(=CC=C3)Cl)C4=NCCCN41
InChI=1SC17H18ClN5Sc1292417211614(151974822(15)17)112023(16)1363512(18)1013h3561011H2479H21H3
MFCD12199740
ZINC000012322216
ZINC12322216

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Available files

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