Vitas-M small molecule compound
2-[4-methoxy-3-(1H-pyrazol-1-ylmethyl)phenyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STL395446
SMILES COc1ccc(cc1Cn1cccn1)c1nc2sc3c(c2c(=O)[nH]1)CCCC3
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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 C21H20N4O2S MW 392.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N4O2S/c1-27-16-8-7-13(11-14(16)12-25-10-4-9-22-25)19-23-20(26)18-15-5-2-3-6-17(15)28-21(18)24-19/h4,7-11H,2-3,5-6,12H2,1H3,(H,23,24,26)InChIKey
NARQLVWQIOHFKD-UHFFFAOYSA-NSynonyms
1005639-54-21005639542
2(4methoxy3(1Hpyrazol1ylmethyl)phenyl)5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
2(4methoxy3(pyrazol1ylmethyl)phenyl)5678tetrahydro3H(1)benzothiolo(23d)pyrimidin4one
COC1=C(C=C(C=C1)C2=NC3=C(C4=C(S3)CCCC4)C(=O)N2)CN5C=CC=N5
COc1ccc(cc1Cn1cccn1)c1nc2sc3c(c2c(=O)(nH)1)CCCC3
InChI=1SC21H20N4O2Sc127168713(1114(16)122510492225)192320(26)1815523617(15)2821(18)2419h4711H235612H21H3(H232426)
MFCD06195951
ZINC000017080182
ZINC17080182
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