Vitas-M small molecule compound
methyl 2-{[8-(4-methylphenyl)-2,3,4,8-tetrahydropyrazolo[4,3-e]pyrimido[1,2-c]pyrimidin-6-yl]sulfanyl}propanoate
Catalog ID
STK631733
SMILES COC(=O)C(Sc1nc2n(ncc2c2=NCCCn12)c1ccc(cc1)C)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 C19H21N5O2S MW 383.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H21N5O2S/c1-12-5-7-14(8-6-12)24-17-15(11-21-24)16-20-9-4-10-23(16)19(22-17)27-13(2)18(25)26-3/h5-8,11,13H,4,9-10H2,1-3H3InChIKey
BZJJOXRJBJQCCM-UHFFFAOYSA-NSynonyms
1010936-58-91010936589
CC1=CC=C(C=C1)N2C3=C(C=N2)C4=NCCCN4C(=N3)SC(C)C(=O)OC
InChI=1SC19H21N5O2Sc1125714(8612)241715(112124)1620941023(16)19(2217)2713(2)18(25)263h581113H4910H213H3
methyl2((8(4methylphenyl)2348tetrahydropyrazolo(43e)pyrimido(12c)pyrimidin6yl)sulfanyl)propanoate
methyl2((8(ptolyl)2348tetrahydropyrazolo(43e)pyrimido(12c)pyrimidin6yl)thio)propanoate
MFCD12199449
ZINC000012321758
ZINC000012321759
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