Vitas-M small molecule compound
7-[({5-[(4-methylphenoxy)methyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl}sulfanyl)methyl]-5H-[1,3]thiazolo[3,2-a]pyrimidin-5-one
Catalog ID
STK466756
SMILES C=CCn1c(COc2ccc(cc2)C)nnc1SCc1cc(=O)n2c(n1)scc2
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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 C20H19N5O2S2 MW 425.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19N5O2S2/c1-3-8-24-17(12-27-16-6-4-14(2)5-7-16)22-23-20(24)29-13-15-11-18(26)25-9-10-28-19(25)21-15/h3-7,9-11H,1,8,12-13H2,2H3InChIKey
AGDIACBKLPQKFQ-UHFFFAOYSA-NSynonyms
7(((5((4methylphenoxy)methyl)4(prop2en1yl)4H124triazol3yl)sulfanyl)methyl)5H(13)thiazolo(32a)pyrimidin5one
7((5((4methylphenoxy)methyl)4prop2enyl124triazol3yl)sulfanylmethyl)(13)thiazolo(32a)pyrimidin5one
7((5((4METHYLPHENOXY)METHYL)4PROP2ENYL124TRIAZOL3YLTHIO)METHYL)4HYDRO13THIAZOLINO(32A)PYRIMIDIN5ONE
CC1=CC=C(C=C1)OCC2=NN=C(N2CC=C)SCC3=CC(=O)N4C=CSC4=N3
InChI=1SC20H19N5O2S2c1382417(1227166414(2)5716)222320(24)2913151118(26)259102819(25)2115h37911H181213H22H3
MFCD06110686
ZINC000017094520
ZINC17094520
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