Vitas-M small molecule compound
N-tert-butyl-2-[(7-tert-butyl-4-oxo-3-phenyl-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetamide
Catalog ID
STK691596
SMILES O=C(NC(C)(C)C)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 C26H33N3O2S2 MW 483.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H33N3O2S2/c1-25(2,3)16-12-13-18-19(14-16)33-22-21(18)23(31)29(17-10-8-7-9-11-17)24(27-22)32-15-20(30)28-26(4,5)6/h7-11,16H,12-15H2,1-6H3,(H,28,30)InChIKey
WOQZZZJLMFKBKV-UHFFFAOYSA-NSynonyms
CC(C)(C)C1CCC2=C(C1)SC3=C2C(=O)N(C(=N3)SCC(=O)NC(C)(C)C)C4=CC=CC=C4
InChI=1SC26H33N3O2S2c125(23)1612131819(1416)332221(18)23(31)29(17108791117)24(2722)321520(30)2826(45)6h71116H1215H216H3(H2830)
MFCD09064663
Ntertbutyl2((7tertbutyl4oxo3phenyl345678hexahydro(1)benzothieno(23d)pyrimidin2yl)sulfanyl)acetamide
Ntertbutyl2((7tertbutyl4oxo3phenyl5678tetrahydro(1)benzothiolo(23d)pyrimidin2yl)sulfanyl)acetamide
ZINC000012364967
ZINC000012364968
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