Vitas-M small molecule compound
2-{[1-(4-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]sulfanyl}-N-(3,5-dimethylphenyl)acetamide
Catalog ID
STL346808
SMILES O=C(Nc1cc(C)cc(c1)C)CSc1ncnc2c1cnn2c1ccc(cc1)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 C21H18ClN5OS MW 423.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18ClN5OS/c1-13-7-14(2)9-16(8-13)26-19(28)11-29-21-18-10-25-27(20(18)23-12-24-21)17-5-3-15(22)4-6-17/h3-10,12H,11H2,1-2H3,(H,26,28)InChIKey
AJPHKKPZXUILQG-UHFFFAOYSA-NSynonyms
848994-79-62((1(4chlorophenyl)1Hpyrazolo(34d)pyrimidin4yl)sulfanyl)N(35dimethylphenyl)acetamide
2((1(4CHLOROPHENYL)1HPYRAZOLO(34D)PYRIMIDIN4YL)THIO)N(35DIMETHYLPHENYL)ACETAMIDE
2(1(4CHLOROPHENYL)PYRAZOLO(34D)PYRIMIDIN4YL)SULFANYLN(35DIMETHYLPHENYL)ACETAMIDE
848994796
CC1=CC(=CC(=C1)NC(=O)CSC2=NC=NC3=C2C=NN3C4=CC=C(C=C4)Cl)C
InChI=1SC21H18ClN5OSc113714(2)916(813)2619(28)11292118102527(20(18)23122421)175315(22)4617h31012H11H212H3(H2628)
MFCD04007337
ZINC000002447397
ZINC02447397
ZINC2447397
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