Vitas-M small molecule compound
2-[3-bromo-4-(prop-2-en-1-yloxy)phenyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STL354436
SMILES C=CCOc1ccc(cc1Br)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 C19H17BrN2O2S MW 417.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17BrN2O2S/c1-2-9-24-14-8-7-11(10-13(14)20)17-21-18(23)16-12-5-3-4-6-15(12)25-19(16)22-17/h2,7-8,10H,1,3-6,9H2,(H,21,22,23)InChIKey
NLSYEKSXQIHDJO-UHFFFAOYSA-NSynonyms
2(3bromo4(prop2en1yloxy)phenyl)5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
2(3bromo4prop2enoxyphenyl)5678tetrahydro3H(1)benzothiolo(23d)pyrimidin4one
C=CCOC1=C(C=C(C=C1)C2=NC3=C(C4=C(S3)CCCC4)C(=O)N2)Br
C=CCOc1ccc(cc1Br)c1nc2sc3c(c2c(=O)(nH)1)CCCC3
InChI=1SC19H17BrN2O2Sc12924148711(1013(14)20)172118(23)1612534615(12)2519(16)2217h27810H1369H2(H212223)
MFCD02212193
ZINC000002884000
ZINC02884000
ZINC2884000
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