Vitas-M small molecule compound
N-(2-chloro-5-fluorophenyl)-2-[(4-oxo-5-phenyl-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl)sulfanyl]acetamide
Catalog ID
STK985808
SMILES O=C(Nc1cc(F)ccc1Cl)CSc1nc2[nH]ncc2c(=O)n1c1ccccc1
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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 C19H13ClFN5O2S MW 429.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H13ClFN5O2S/c20-14-7-6-11(21)8-15(14)23-16(27)10-29-19-24-17-13(9-22-25-17)18(28)26(19)12-4-2-1-3-5-12/h1-9H,10H2,(H,22,25)(H,23,27)InChIKey
AHEBWUWJWSBNEN-UHFFFAOYSA-NSynonyms
C1=CC=C(C=C1)N2C(=O)C3=C(NN=C3)N=C2SCC(=O)NC4=C(C=CC(=C4)F)Cl
InChI=1SC19H13ClFN5O2Sc20147611(21)815(14)2316(27)102919241713(9222517)18(28)26(19)124213512h19H10H2(H2225)(H2327)
MFCD18182753
N(2chloro5fluorophenyl)2((4oxo5phenyl1Hpyrazolo(34d)pyrimidin6yl)sulfanyl)acetamide
N(2chloro5fluorophenyl)2((4oxo5phenyl45dihydro1Hpyrazolo(34d)pyrimidin6yl)sulfanyl)acetamide
O=C(Nc1cc(F)ccc1Cl)CSc1nc2(nH)ncc2c(=O)n1c1ccccc1
ZINC000051316714
ZINC51316714
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