Vitas-M small molecule compound
2-(4-bromophenyl)-N-(4-oxo-2-sulfanyl-6,7,8,9-tetrahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-3(5H)-yl)acetamide
Catalog ID
STK449032
SMILES Brc1ccc(cc1)CC(=O)Nn1c(S)nc2c(c1=O)c1CCCCCc1s2
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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 C19H18BrN3O2S2 MW 464.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18BrN3O2S2/c20-12-8-6-11(7-9-12)10-15(24)22-23-18(25)16-13-4-2-1-3-5-14(13)27-17(16)21-19(23)26/h6-9H,1-5,10H2,(H,21,26)(H,22,24)InChIKey
BLNXTZSPLSLPLW-UHFFFAOYSA-NSynonyms
2(4bromophenyl)N(4oxo2sulfanyl6789tetrahydro4Hcyclohepta(45)thieno(23d)pyrimidin3(5H)yl)acetamide
2(4bromophenyl)N(4oxo2sulfanylidene156789hexahydrocyclohepta(23)thieno(24b)pyrimidin3yl)acetamide
C1CCC2=C(CC1)SC3=C2C(=O)N(C(=S)N3)NC(=O)CC4=CC=C(C=C4)Br
InChI=1SC19H18BrN3O2S2c20128611(7912)1015(24)222318(25)16134213514(13)2717(16)2119(23)26h69H1510H2(H2126)(H2224)
MFCD06091117
ZINC000020457664
ZINC20457664
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