Vitas-M small molecule compound
2-{[1-(4-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]sulfanyl}-N-(3,5-dimethoxyphenyl)acetamide
Catalog ID
STL348073
SMILES COc1cc(NC(=O)CSc2ncnc3c2cnn3c2ccc(cc2)Cl)cc(c1)OC
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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 C21H18ClN5O3S MW 455.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18ClN5O3S/c1-29-16-7-14(8-17(9-16)30-2)26-19(28)11-31-21-18-10-25-27(20(18)23-12-24-21)15-5-3-13(22)4-6-15/h3-10,12H,11H2,1-2H3,(H,26,28)InChIKey
HTBLBVJYSLTUQI-UHFFFAOYSA-NSynonyms
579440-81-62((1(4chlorophenyl)1Hpyrazolo(34d)pyrimidin4yl)sulfanyl)N(35dimethoxyphenyl)acetamide
2((1(4chlorophenyl)1Hpyrazolo(34d)pyrimidin4yl)thio)N(35dimethoxyphenyl)acetamide
2(1(4CHLOROPHENYL)PYRAZOLO(34D)PYRIMIDIN4YL)SULFANYLN(35DIMETHOXYPHENYL)ACETAMIDE
579440816
COC1=CC(=CC(=C1)NC(=O)CSC2=NC=NC3=C2C=NN3C4=CC=C(C=C4)Cl)OC
InChI=1SC21H18ClN5O3Sc12916714(817(916)302)2619(28)11312118102527(20(18)23122421)155313(22)4615h31012H11H212H3(H2628)
MFCD04032543
ZINC000009332278
ZINC09332278
ZINC9332278
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