Vitas-M small molecule compound
2-[(4-amino-7-tert-butyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]-1-(4-chlorophenyl)ethanone
Catalog ID
STK805056
SMILES Clc1ccc(cc1)C(=O)CSc1nc(N)c2c(n1)sc1c2CCC(C1)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 C22H24ClN3OS2 MW 446.04 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24ClN3OS2/c1-22(2,3)13-6-9-15-17(10-13)29-20-18(15)19(24)25-21(26-20)28-11-16(27)12-4-7-14(23)8-5-12/h4-5,7-8,13H,6,9-11H2,1-3H3,(H2,24,25,26)InChIKey
DEMPSQHHCGMRJY-UHFFFAOYSA-NSynonyms
351008-61-22((4amino7(tertbutyl)5678tetrahydrobenzo(45)thieno(23d)pyrimidin2yl)thio)1(4chlorophenyl)ethanone
2((4amino7tertbutyl5678tetrahydro(1)benzothieno(23d)pyrimidin2yl)sulfanyl)1(4chlorophenyl)ethanone
2((4amino7tertbutyl5678tetrahydro(1)benzothiolo(23d)pyrimidin2yl)sulfanyl)1(4chlorophenyl)ethanone
351008612
CC(C)(C)C1CCC2=C(C1)SC3=NC(=NC(=C23)N)SCC(=O)C4=CC=C(C=C4)Cl
InChI=1SC22H24ClN3OS2c122(23)13691517(1013)292018(15)19(24)2521(2620)281116(27)124714(23)8512h457813H6911H213H3(H2242526)
MFCD01562812
ZINC000008951303
ZINC000008951502
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