Vitas-M small molecule compound
N-(5-chloro-2-methoxyphenyl)-2-{4-oxo-1-[4-(propan-2-yl)phenyl]-1,4-dihydro-5H-pyrazolo[3,4-d]pyrimidin-5-yl}acetamide
Catalog ID
STL074430
SMILES COc1ccc(cc1NC(=O)Cn1cnc2c(c1=O)cnn2c1ccc(cc1)C(C)C)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 C23H22ClN5O3 MW 451.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22ClN5O3/c1-14(2)15-4-7-17(8-5-15)29-22-18(11-26-29)23(31)28(13-25-22)12-21(30)27-19-10-16(24)6-9-20(19)32-3/h4-11,13-14H,12H2,1-3H3,(H,27,30)InChIKey
GJAPMLZCWSKRFP-UHFFFAOYSA-NSynonyms
CC(C)C1=CC=C(C=C1)N2C3=C(C=N2)C(=O)N(C=N3)CC(=O)NC4=C(C=CC(=C4)Cl)OC
InChI=1SC23H22ClN5O3c114(2)154717(8515)292218(112629)23(31)28(132522)1221(30)27191016(24)6920(19)323h4111314H12H213H3(H2730)
MFCD18195824
N(5chloro2methoxyphenyl)2(4oxo1(4(propan2yl)phenyl)14dihydro5Hpyrazolo(34d)pyrimidin5yl)acetamide
N(5chloro2methoxyphenyl)2(4oxo1(4propan2ylphenyl)pyrazolo(34d)pyrimidin5yl)acetamide
ZINC000057486518
ZINC57486518
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