Vitas-M small molecule compound
7-tert-butyl-2-[(4-fluorobenzyl)sulfanyl]-3-phenyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STK735685
SMILES Fc1ccc(cc1)CSc1nc2sc3c(c2c(=O)n1c1ccccc1)CCC(C3)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 C27H27FN2OS2 MW 478.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27FN2OS2/c1-27(2,3)18-11-14-21-22(15-18)33-24-23(21)25(31)30(20-7-5-4-6-8-20)26(29-24)32-16-17-9-12-19(28)13-10-17/h4-10,12-13,18H,11,14-16H2,1-3H3InChIKey
USECQCSQEHIUAQ-UHFFFAOYSA-NSynonyms
7tertbutyl2((4fluorobenzyl)sulfanyl)3phenyl5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
7tertbutyl2((4fluorophenyl)methylsulfanyl)3phenyl5678tetrahydro(1)benzothiolo(23d)pyrimidin4one
CC(C)(C)C1CCC2=C(C1)SC3=C2C(=O)N(C(=N3)SCC4=CC=C(C=C4)F)C5=CC=CC=C5
InChI=1SC27H27FN2OS2c127(23)1811142122(1518)332423(21)25(31)30(207546820)26(2924)32161791219(28)131017h410121318H111416H213H3
MFCD01465246
ZINC000003666853
ZINC000003666854
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