Vitas-M small molecule compound
7-[(2-bromoprop-2-en-1-yl)sulfanyl]-4-phenyl-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
Catalog ID
STK544630
SMILES BrC(=C)CSc1ncnc2c1sc1c2c2CCCc2c(n1)c1ccccc1
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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 C21H16BrN3S2 MW 454.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16BrN3S2/c1-12(22)10-26-21-19-18(23-11-24-21)16-14-8-5-9-15(14)17(25-20(16)27-19)13-6-3-2-4-7-13/h2-4,6-7,11H,1,5,8-10H2InChIKey
ZIZRYALVFSRLBM-UHFFFAOYSA-NSynonyms
500269-99-8500269998
7((2bromoallyl)thio)4phenyl23dihydro1Hcyclopenta(45)pyrido(3245)thieno(32d)pyrimidine
7((2bromoprop2en1yl)sulfanyl)4phenyl23dihydro1Hcyclopenta(45)pyrido(3245)thieno(32d)pyrimidine
C=C(CSC1=NC=NC2=C1SC3=NC(=C4CCCC4=C23)C5=CC=CC=C5)Br
InChI=1SC21H16BrN3S2c112(22)1026211918(23112421)161485915(14)17(2520(16)2719)136324713h246711H15810H2
MFCD03299815
ZINC000013597224
ZINC13597224
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