Vitas-M small molecule compound
{[4-butyl-9-(methylsulfanyl)-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-yl]sulfanyl}acetic acid
Catalog ID
STL304337
SMILES CCCCc1nc2sc3c(c2c2c1CCC2)nc(nc3SCC(=O)O)SC
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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 C19H21N3O2S3 MW 419.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H21N3O2S3/c1-3-4-8-12-10-6-5-7-11(10)14-15-16(27-17(14)20-12)18(26-9-13(23)24)22-19(21-15)25-2/h3-9H2,1-2H3,(H,23,24)InChIKey
KQGNBHSZZCKCFJ-UHFFFAOYSA-NSynonyms
848764-85-2((4butyl9(methylsulfanyl)23dihydro1Hcyclopenta(45)pyrido(3245)thieno(32d)pyrimidin7yl)sulfanyl)aceticacid
2((4butyl9(methylthio)23dihydro1Hcyclopenta(45)pyrido(3245)thieno(32d)pyrimidin7yl)thio)aceticacid
848764852
CCCCC1=C2CCCC2=C3C4=C(C(=NC(=N4)SC)SCC(=O)O)SC3=N1
InChI=1SC19H21N3O2S3c1348121065711(10)141516(2717(14)2012)18(26913(23)24)2219(2115)252h39H212H3(H2324)
MFCD04192864
ZINC000002428172
ZINC2428172
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