Vitas-M small molecule compound
N-(7-tert-butyl-2-methyl-4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)-2-(4-chloro-3-methyl-1H-pyrazol-1-yl)acetamide
Catalog ID
STK303853
SMILES O=C(Nn1c(C)nc2c(c1=O)c1CCC(Cc1s2)C(C)(C)C)Cn1cc(c(n1)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 C21H26ClN5O2S MW 447.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H26ClN5O2S/c1-11-15(22)9-26(24-11)10-17(28)25-27-12(2)23-19-18(20(27)29)14-7-6-13(21(3,4)5)8-16(14)30-19/h9,13H,6-8,10H2,1-5H3,(H,25,28)InChIKey
PSYANFNYUCRMOY-UHFFFAOYSA-NSynonyms
1005581-46-31005581463
CC1=NN(C=C1Cl)CC(=O)NN2C(=NC3=C(C2=O)C4=C(S3)CC(CC4)C(C)(C)C)C
InChI=1SC21H26ClN5O2Sc11115(22)926(2411)1017(28)252712(2)231918(20(27)29)147613(21(34)5)816(14)3019h913H6810H215H3(H2528)
MFCD04044904
N(7tertbutyl2methyl4oxo5678tetrahydro(1)benzothieno(23d)pyrimidin3(4H)yl)2(4chloro3methyl1Hpyrazol1yl)acetamide
N(7tertbutyl2methyl4oxo5678tetrahydro(1)benzothiolo(23d)pyrimidin3yl)2(4chloro3methylpyrazol1yl)acetamide
ZINC000002778626
ZINC000002778627
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