Vitas-M small molecule compound
2-[(5-phenyl-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-yl)sulfanyl]acetamide
Catalog ID
STK721263
SMILES NC(=O)CSc1ncnc2c1sc1c2c2CCCCc2c(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 C21H18N4OS2 MW 406.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18N4OS2/c22-15(26)10-27-21-19-18(23-11-24-21)16-13-8-4-5-9-14(13)17(25-20(16)28-19)12-6-2-1-3-7-12/h1-3,6-7,11H,4-5,8-10H2,(H2,22,26)InChIKey
OUBMSBCGZORCBH-UHFFFAOYSA-NSynonyms
2((5phenyl1234tetrahydropyrimido(4545)thieno(23c)isoquinolin8yl)sulfanyl)acetamide
2((5phenyl1234tetrahydropyrimido(4545)thieno(23c)isoquinolin8yl)thio)acetamide
C1CCC2=C(N=C3C(=C2C1)C4=C(S3)C(=NC=N4)SCC(=O)N)C5=CC=CC=C5
InChI=1SC21H18N4OS2c2215(26)1027211918(23112421)1613845914(13)17(2520(16)2819)126213712h136711H45810H2(H22226)
MFCD02993775
ZINC000002301325
ZINC02301325
ZINC2301325
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