Vitas-M small molecule compound
3-(3,4-dimethylphenyl)-2-[(3-fluorobenzyl)sulfanyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STL416499
SMILES Fc1cccc(c1)CSc1nc2sc3c(c2c(=O)n1c1ccc(c(c1)C)C)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 C25H23FN2OS2 MW 450.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23FN2OS2/c1-15-10-11-19(12-16(15)2)28-24(29)22-20-8-3-4-9-21(20)31-23(22)27-25(28)30-14-17-6-5-7-18(26)13-17/h5-7,10-13H,3-4,8-9,14H2,1-2H3InChIKey
BIHIQHCKZSLDFT-UHFFFAOYSA-NSynonyms
3(34dimethylphenyl)2((3fluorobenzyl)sulfanyl)5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
3(34dimethylphenyl)2((3fluorophenyl)methylsulfanyl)5678tetrahydro(1)benzothiolo(23d)pyrimidin4one
CC1=C(C=C(C=C1)N2C(=O)C3=C(N=C2SCC4=CC(=CC=C4)F)SC5=C3CCCC5)C
InChI=1SC25H23FN2OS2c115101119(1216(15)2)2824(29)2220834921(20)3123(22)2725(28)30141765718(26)1317h571013H348914H212H3
MFCD03864631
ZINC000002143296
ZINC02143296
ZINC2143296
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