Vitas-M small molecule compound
8-(3-chloro-4-methylphenyl)-6-(prop-2-en-1-ylsulfanyl)-2,3,4,8-tetrahydropyrazolo[4,3-e]pyrimido[1,2-c]pyrimidine
Catalog ID
STK647030
SMILES C=CCSc1nc2n(ncc2c2=NCCCn12)c1ccc(c(c1)Cl)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 C18H18ClN5S MW 371.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18ClN5S/c1-3-9-25-18-22-17-14(16-20-7-4-8-23(16)18)11-21-24(17)13-6-5-12(2)15(19)10-13/h3,5-6,10-11H,1,4,7-9H2,2H3InChIKey
XRNFWPFHWBXWFT-UHFFFAOYSA-NSynonyms
1010915-32-81010915328
6(allylthio)8(3chloro4methylphenyl)2348tetrahydropyrazolo(43e)pyrimido(12c)pyrimidine
8(3chloro4methylphenyl)6(prop2en1ylsulfanyl)2348tetrahydropyrazolo(43e)pyrimido(12c)pyrimidine
CC1=C(C=C(C=C1)N2C3=C(C=N2)C4=NCCCN4C(=N3)SCC=C)Cl
InChI=1SC18H18ClN5Sc1392518221714(162074823(16)18)112124(17)136512(2)15(19)1013h3561011H1479H22H3
MFCD12199147
ZINC000012321291
ZINC12321291
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