Vitas-M small molecule compound
2-{[9-(methylsulfanyl)-4-phenyl-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-yl]sulfanyl}ethanol
Catalog ID
STL304361
SMILES OCCSc1nc(SC)nc2c1sc1c2c2CCCc2c(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 C21H19N3OS3 MW 425.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19N3OS3/c1-26-21-23-17-15-13-8-5-9-14(13)16(12-6-3-2-4-7-12)22-19(15)28-18(17)20(24-21)27-11-10-25/h2-4,6-7,25H,5,8-11H2,1H3InChIKey
KUMSHEBISOKKSK-UHFFFAOYSA-NSynonyms
846579-23-52((9(methylsulfanyl)4phenyl23dihydro1Hcyclopenta(45)pyrido(3245)thieno(32d)pyrimidin7yl)sulfanyl)ethanol
2((9(methylthio)4phenyl23dihydro1Hcyclopenta(45)pyrido(3245)thieno(32d)pyrimidin7yl)thio)ethanol
846579235
CSC1=NC2=C(C(=N1)SCCO)SC3=NC(=C4CCCC4=C23)C5=CC=CC=C5
InChI=1SC21H19N3OS3c126212317151385914(13)16(126324712)2219(15)2818(17)20(2421)27111025h246725H5811H21H3
MFCD04174973
ZINC000002448956
ZINC02448956
ZINC2448956
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