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)-1-ethyl-1H-pyrazole-5-carboxamide
Catalog ID
STK303950
SMILES CCn1nccc1C(=O)Nn1c(C)nc2c(c1=O)c1CCC(Cc1s2)C(C)(C)C
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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 C21H27N5O2S MW 413.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27N5O2S/c1-6-25-15(9-10-22-25)18(27)24-26-12(2)23-19-17(20(26)28)14-8-7-13(21(3,4)5)11-16(14)29-19/h9-10,13H,6-8,11H2,1-5H3,(H,24,27)InChIKey
BEXNOMOZBMGPJF-UHFFFAOYSA-NSynonyms
1005633-12-41005633124
CCN1C(=CC=N1)C(=O)NN2C(=NC3=C(C2=O)C4=C(S3)CC(CC4)C(C)(C)C)C
InChI=1SC21H27N5O2Sc162515(9102225)18(27)242612(2)231917(20(26)28)148713(21(34)5)1116(14)2919h91013H6811H215H3(H2427)
MFCD04043466
N(7tertbutyl2methyl4oxo5678tetrahydro(1)benzothieno(23d)pyrimidin3(4H)yl)1ethyl1Hpyrazole5carboxamide
N(7tertbutyl2methyl4oxo5678tetrahydro(1)benzothiolo(23d)pyrimidin3yl)2ethylpyrazole3carboxamide
ZINC000002778930
ZINC000002778931
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