Vitas-M small molecule compound

methyl [(4-phenyl-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-yl)sulfanyl]acetate

Catalog ID
STK541804
SMILES COC(=O)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 C21H17N3O2S2 MW 407.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17N3O2S2/c1-26-15(25)10-27-21-19-18(22-11-23-21)16-13-8-5-9-14(13)17(24-20(16)28-19)12-6-3-2-4-7-12/h2-4,6-7,11H,5,8-10H2,1H3
InChIKey
ATOKNTZRAWJDKJ-UHFFFAOYSA-N
Synonyms
488706-60-1
488706601
COC(=O)CSC1=NC=NC2=C1SC3=NC(=C4CCCC4=C23)C5=CC=CC=C5
InChI=1SC21H17N3O2S2c12615(25)1027211918(22112321)161385914(13)17(2420(16)2819)126324712h246711H5810H21H3
methyl((4phenyl23dihydro1Hcyclopenta(45)pyrido(3245)thieno(32d)pyrimidin7yl)sulfanyl)acetate
methyl2((4phenyl23dihydro1Hcyclopenta(45)pyrido(3245)thieno(32d)pyrimidin7yl)thio)acetate
MFCD03290535
ZINC000004869751
ZINC04869751
ZINC4869751

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Available files

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