Vitas-M small molecule compound
N-(4-acetylphenyl)-2-{[5-(morpholin-4-yl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-yl]sulfanyl}acetamide
Catalog ID
STK542433
SMILES O=C(Nc1ccc(cc1)C(=O)C)CSc1ncnc2c1sc1c2c2CCCCc2c(n1)N1CCOCC1
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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 C27H27N5O3S2 MW 533.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27N5O3S2/c1-16(33)17-6-8-18(9-7-17)30-21(34)14-36-27-24-23(28-15-29-27)22-19-4-2-3-5-20(19)25(31-26(22)37-24)32-10-12-35-13-11-32/h6-9,15H,2-5,10-14H2,1H3,(H,30,34)InChIKey
BJXZVFDIRPACHX-UHFFFAOYSA-NSynonyms
488726-06-3488726063
CC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NC=NC3=C2SC4=NC(=C5CCCCC5=C34)N6CCOCC6
InChI=1SC27H27N5O3S2c116(33)176818(9717)3021(34)1436272423(28152927)2219423520(19)25(3126(22)3724)32101235131132h6915H251014H21H3(H3034)
MFCD03291589
N(4acetylphenyl)2((5(morpholin4yl)1234tetrahydropyrimido(4545)thieno(23c)isoquinolin8yl)sulfanyl)acetamide
N(4acetylphenyl)2((5morpholino1234tetrahydropyrimido(4545)thieno(23c)isoquinolin8yl)thio)acetamide
ZINC000053290980
ZINC53290980
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