Vitas-M small molecule compound
2-[3-bromo-4-(dimethylamino)phenyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STK070479
SMILES CN(c1ccc(cc1Br)c1nc2sc3c(c2c(=O)[nH]1)CCCC3)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 C18H18BrN3OS MW 404.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18BrN3OS/c1-22(2)13-8-7-10(9-12(13)19)16-20-17(23)15-11-5-3-4-6-14(11)24-18(15)21-16/h7-9H,3-6H2,1-2H3,(H,20,21,23)InChIKey
ZGBLQMLLFGUDKH-UHFFFAOYSA-NSynonyms
2(3bromo4(dimethylamino)phenyl)5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
2(3bromo4(dimethylamino)phenyl)5678tetrahydro3H(1)benzothiolo(23d)pyrimidin4one
CN(C)C1=C(C=C(C=C1)C2=NC3=C(C4=C(S3)CCCC4)C(=O)N2)Br
CN(c1ccc(cc1Br)c1nc2sc3c(c2c(=O)(nH)1)CCCC3)C
InChI=1SC18H18BrN3OSc122(2)138710(912(13)19)162017(23)1511534614(11)2418(15)2116h79H36H212H3(H202123)
MFCD02297195
STK070479
ZINC000005728218
ZINC05728218
ZINC5728218
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